smiles zinc_id prot_id files.db2 substance.inchikey net_charge ph_mod_fk substance.mwt substance.logp purchasable reactive features tranche_name CSCC[C@H](N)C(=O)N[C@@H](CC(C)C)c1ccccc1C ZINC000159692382 186135599 /nfs/dbraw/zinc/13/55/99/186135599.db2.gz MHKVRKHBYUICLG-HOTGVXAUSA-N 0 3 308.491 3.279 20 70 DGIDHN NC(=O)CC1CCN(Cc2cccc(OC3CCCC3)c2)CC1 ZINC000159742195 186138993 /nfs/dbraw/zinc/13/89/93/186138993.db2.gz NFNZLEVBMKWNDR-UHFFFAOYSA-N 0 3 316.445 3.095 20 70 DGIDHN COc1ccc2c(c1)[C@H](NC[C@@](C)(O)c1ccsc1)CC2 ZINC000159944897 197375742 /nfs/dbraw/zinc/37/57/42/197375742.db2.gz URRUQPIJMMNQQC-IAGOWNOFSA-N 0 3 303.427 3.241 20 70 DGIDHN CC(C)N(Cc1ccccc1)C(=O)N[C@H]1CCN(CC2CC2)C1 ZINC000160652085 400735471 /nfs/dbraw/zinc/73/54/71/400735471.db2.gz JHHBJKAYMIBVIB-SFHVURJKSA-N 0 3 315.461 3.091 20 70 DGIDHN O=C(N[C@H]1CCN(CC2CC2)C1)N(CC1CC1)C1CCCCC1 ZINC000160753509 400736211 /nfs/dbraw/zinc/73/62/11/400736211.db2.gz SKUJFLKGPLQCOB-KRWDZBQOSA-N 0 3 319.493 3.225 20 70 DGIDHN CC[C@@H](NCCn1c2ccccc2oc1=O)c1ccc(F)cc1 ZINC000160895584 400736378 /nfs/dbraw/zinc/73/63/78/400736378.db2.gz ZLLWFFFELWHMPU-OAHLLOKOSA-N 0 3 314.360 3.475 20 70 DGIDHN CCS[C@@H]1CCCC[C@@H]1NC(=O)N(CCN(C)C)C(C)C ZINC000159488949 286707225 /nfs/dbraw/zinc/70/72/25/286707225.db2.gz PMSYQQZMICDHEG-LSDHHAIUSA-N 0 3 315.527 3.032 20 70 DGIDHN C[C@@H](C(=O)NCCc1cc2ccccc2[nH]1)N1[C@@H](C)CC[C@@H]1C ZINC000159702061 432694308 /nfs/dbraw/zinc/69/43/08/432694308.db2.gz AKFOBTKKPOMWGT-KKUMJFAQSA-N 0 3 313.445 3.088 20 70 DGIDHN Cc1ccccc1CNc1ccc(OC2CCN(C)CC2)nc1 ZINC000160106305 432706507 /nfs/dbraw/zinc/70/65/07/432706507.db2.gz MTGNDYDUHHNOKO-UHFFFAOYSA-N 0 3 311.429 3.475 20 70 DGIDHN CSC[C@H](CCO)N[C@H](C)c1sc(C(C)C)nc1C ZINC000160201369 432710406 /nfs/dbraw/zinc/71/04/06/432710406.db2.gz WBHVRWODABVNCB-PWSUYJOCSA-N 0 3 302.509 3.340 20 70 DGIDHN COc1ccc([C@H](C)N[C@H](CCO)CSC)cc1Cl ZINC000160225144 432711319 /nfs/dbraw/zinc/71/13/19/432711319.db2.gz HFXQKDRTFMGVIF-CMPLNLGQSA-N 0 3 303.855 3.113 20 70 DGIDHN CCCN1CCCN(C(=O)c2cc(C)n(C(C)C)c2C)CC1 ZINC000160359438 432715751 /nfs/dbraw/zinc/71/57/51/432715751.db2.gz FXYQJXAKNZIJHI-UHFFFAOYSA-N 0 3 305.466 3.244 20 70 DGIDHN CCN1CCC(NC(=O)[C@H](C)Cc2cccc(Cl)c2)CC1 ZINC000160337836 432715854 /nfs/dbraw/zinc/71/58/54/432715854.db2.gz KDUUZFXCQZCPEP-CYBMUJFWSA-N 0 3 308.853 3.119 20 70 DGIDHN CC(C)(C)c1nsc(N2CCC[C@H]2CN2CCCCC2)n1 ZINC000160446552 432720890 /nfs/dbraw/zinc/72/08/90/432720890.db2.gz JFXHHQBFRORYSU-ZDUSSCGKSA-N 0 3 308.495 3.290 20 70 DGIDHN COc1ccc(CNC(=O)CN[C@@H](C)c2sccc2C)cc1 ZINC000160981271 432753203 /nfs/dbraw/zinc/75/32/03/432753203.db2.gz YBPPSRLLLIQJHQ-ZDUSSCGKSA-N 0 3 318.442 3.032 20 70 DGIDHN CC(C)N(CCN(C)C)C(=O)[C@H](C)Cc1cccc(Cl)c1 ZINC000161184885 432765645 /nfs/dbraw/zinc/76/56/45/432765645.db2.gz ZZJPPQRYTHTJOD-CQSZACIVSA-N 0 3 310.869 3.317 20 70 DGIDHN CC[C@@H](C(=O)N1CCC[C@@H]2CN(C)CC[C@@H]21)c1ccc(F)cc1 ZINC000161264646 432769956 /nfs/dbraw/zinc/76/99/56/432769956.db2.gz GJCNVSYMMXTNIV-NXHRZFHOSA-N 0 3 318.436 3.262 20 70 DGIDHN O=C(NC[C@@H](c1ccccc1)N1CCCC1)N[C@H]1C=CCCC1 ZINC000161394780 432776413 /nfs/dbraw/zinc/77/64/13/432776413.db2.gz XEVPCIJGPOKZHV-ROUUACIJSA-N 0 3 313.445 3.231 20 70 DGIDHN CC(=O)Nc1cccc([C@H](C)NC[C@H](CO)c2ccccc2)c1 ZINC000161401411 432776710 /nfs/dbraw/zinc/77/67/10/432776710.db2.gz HJFXHBACBGDXEX-KBXCAEBGSA-N 0 3 312.413 3.072 20 70 DGIDHN COc1ccc([C@H](C)NC[C@@H](CO)c2ccccc2)c(F)c1 ZINC000161426749 432778378 /nfs/dbraw/zinc/77/83/78/432778378.db2.gz LIKOKPCVEZOAOA-ZFWWWQNUSA-N 0 3 303.377 3.261 20 70 DGIDHN Clc1cccc(CN2CCC[C@H](c3nnc4n3CCC4)C2)c1 ZINC000161406109 432778699 /nfs/dbraw/zinc/77/86/99/432778699.db2.gz WMLMMKRTIMMZBH-AWEZNQCLSA-N 0 3 316.836 3.257 20 70 DGIDHN CC[C@@H](NCC(=O)N1CCc2ccccc21)c1ccc(F)cc1 ZINC000160866531 432745662 /nfs/dbraw/zinc/74/56/62/432745662.db2.gz CXCNAXLIBVTEEV-QGZVFWFLSA-N 0 3 312.388 3.456 20 70 DGIDHN CCc1oc2ccccc2c1CN(C)C(=O)[C@@H](CC)N(C)C ZINC000159441108 292792589 /nfs/dbraw/zinc/79/25/89/292792589.db2.gz ULVSKAFSAZYNKJ-OAHLLOKOSA-N 0 3 302.418 3.294 20 70 DGIDHN Cc1cccc(C(=O)NC[C@@H](Cc2ccccc2)N(C)C)c1F ZINC000159631809 292797037 /nfs/dbraw/zinc/79/70/37/292797037.db2.gz GGQUFMAEFIWPFZ-MRXNPFEDSA-N 0 3 314.404 3.037 20 70 DGIDHN Cc1cc(C)c(C(=O)NC[C@@H](c2cccs2)N2CCCC2)[nH]1 ZINC000159671052 292798014 /nfs/dbraw/zinc/79/80/14/292798014.db2.gz KVOYXCOAFXRCSP-AWEZNQCLSA-N 0 3 317.458 3.260 20 70 DGIDHN COc1cccc(N2CCN(Cc3cccc4[nH]ccc43)CC2)c1 ZINC000160697193 292819710 /nfs/dbraw/zinc/81/97/10/292819710.db2.gz CRUCZJKWKAEJAG-UHFFFAOYSA-N 0 3 321.424 3.499 20 70 DGIDHN CC(C)N(CCN(C)C)C(=O)[C@@H](C)Cc1cccc(Cl)c1 ZINC000161184771 292831001 /nfs/dbraw/zinc/83/10/01/292831001.db2.gz ZZJPPQRYTHTJOD-AWEZNQCLSA-N 0 3 310.869 3.317 20 70 DGIDHN Cc1csc(CNC(C)(C)CN(C)Cc2ccccc2)n1 ZINC000159390614 293032385 /nfs/dbraw/zinc/03/23/85/293032385.db2.gz KEMILKGVTBQQKK-UHFFFAOYSA-N 0 3 303.475 3.452 20 70 DGIDHN C[C@H](CN1CCCCC1)NC(=O)[C@H]1C[C@@H]1c1cc(F)ccc1F ZINC000160364912 524330188 /nfs/dbraw/zinc/33/01/88/524330188.db2.gz VABQJHQPMZZBQE-XPKDYRNWSA-N 0 3 322.399 3.059 20 70 DGIDHN C[C@H](CN1CCCCC1)NC(=O)[C@@H]1C[C@@H]1c1cc(F)ccc1F ZINC000160364650 524330359 /nfs/dbraw/zinc/33/03/59/524330359.db2.gz VABQJHQPMZZBQE-XNRPHZJLSA-N 0 3 322.399 3.059 20 70 DGIDHN C[C@@H](CN1CCCCC1)NC(=O)[C@@H]1C[C@@H]1c1cc(F)ccc1F ZINC000160364526 524606052 /nfs/dbraw/zinc/60/60/52/524606052.db2.gz VABQJHQPMZZBQE-JGGQBBKZSA-N 0 3 322.399 3.059 20 70 DGIDHN CSC[C@@H](CCO)N[C@@H](C)c1ccc(F)cc1OC(F)F ZINC000160391112 525641457 /nfs/dbraw/zinc/64/14/57/525641457.db2.gz SJQBBAIBVPUOSJ-GXSJLCMTSA-N 0 3 323.380 3.192 20 70 DGIDHN CSC[C@@H](CCO)N[C@@H](C)c1ccc(OC(F)(F)F)cc1 ZINC000160413441 525643226 /nfs/dbraw/zinc/64/32/26/525643226.db2.gz OQKMTGOZXDBXNJ-CMPLNLGQSA-N 0 3 323.380 3.350 20 70 DGIDHN CSC[C@@H](CCO)N[C@H](C)c1ccc(F)cc1OC(F)F ZINC000160391297 525643330 /nfs/dbraw/zinc/64/33/30/525643330.db2.gz SJQBBAIBVPUOSJ-MWLCHTKSSA-N 0 3 323.380 3.192 20 70 DGIDHN CSC[C@H](CCO)N[C@@H](C)c1cccc(OC(F)(F)F)c1 ZINC000160411597 525699424 /nfs/dbraw/zinc/69/94/24/525699424.db2.gz OASULHXOQSDAPU-JQWIXIFHSA-N 0 3 323.380 3.350 20 70 DGIDHN CSC[C@H](CCO)N[C@H](C)c1ccc(OCC(C)C)cc1 ZINC000160285153 525700834 /nfs/dbraw/zinc/70/08/34/525700834.db2.gz VKCBRHAIRJQDSM-ZBFHGGJFSA-N 0 3 311.491 3.486 20 70 DGIDHN Cc1cc(NC(=O)[C@H](N)CC(C)C)ccc1OCC(F)(F)F ZINC000159563112 546054438 /nfs/dbraw/zinc/05/44/38/546054438.db2.gz LYKADNULIKIZHQ-GFCCVEGCSA-N 0 3 318.339 3.248 20 70 DGIDHN C[C@@H](CC(=O)N1CCC[C@@H]1CN1CCCCC1)c1ccncc1 ZINC000159909110 546057301 /nfs/dbraw/zinc/05/73/01/546057301.db2.gz BFDPOHZMSRVQBV-FUHWJXTLSA-N 0 3 315.461 3.052 20 70 DGIDHN CSCC[C@@H](N)C(=O)N[C@H](CC(C)C)c1ccccc1C ZINC000159695199 186135976 /nfs/dbraw/zinc/13/59/76/186135976.db2.gz MHKVRKHBYUICLG-HZPDHXFCSA-N 0 3 308.491 3.279 20 70 DGIDHN CCN(C(=O)[C@H](C)[C@H](N)c1ccccc1)c1nc(C)cs1 ZINC000160174030 197391291 /nfs/dbraw/zinc/39/12/91/197391291.db2.gz OSKWDGCYJZHQHT-OCCSQVGLSA-N 0 3 303.431 3.141 20 70 DGIDHN Cc1cncc(/C=C/C(=O)NCCCN(C)Cc2ccccc2)c1 ZINC000160220304 197394333 /nfs/dbraw/zinc/39/43/33/197394333.db2.gz WSMYPDWUOHXMAU-MDZDMXLPSA-N 0 3 323.440 3.042 20 70 DGIDHN CCN(CC)Cc1cccc(NC(=O)[C@@H]2CCC(=O)C[C@@H]2C)c1 ZINC000159840787 197368413 /nfs/dbraw/zinc/36/84/13/197368413.db2.gz NUJRFQRYMIEARC-KBXCAEBGSA-N 0 3 316.445 3.472 20 70 DGIDHN CCn1cc([C@@H](C)NC[C@@H](C)N2CCc3ccccc3C2)cn1 ZINC000159816732 197366547 /nfs/dbraw/zinc/36/65/47/197366547.db2.gz HOWCXKWHLDJVHN-HZPDHXFCSA-N 0 3 312.461 3.000 20 70 DGIDHN Cc1ccc(N[C@H](C)CCn2cccn2)c(OCCN(C)C)c1 ZINC000159462236 197355216 /nfs/dbraw/zinc/35/52/16/197355216.db2.gz UDZLGQDJMVTAAD-MRXNPFEDSA-N 0 3 316.449 3.023 20 70 DGIDHN C[C@@H](C(=O)N[C@H]1CCOC2(CCCCC2)C1)N1CCCCCC1 ZINC000160729660 286782797 /nfs/dbraw/zinc/78/27/97/286782797.db2.gz DXEFOPLWCYSZBN-IRXDYDNUSA-N 0 3 322.493 3.249 20 70 DGIDHN CN(CCOc1cccc(Cl)c1)C[C@H](O)Cc1ccccc1 ZINC000218763190 263836203 /nfs/dbraw/zinc/83/62/03/263836203.db2.gz QOYVQXFVIKYLBG-QGZVFWFLSA-N 0 3 319.832 3.254 20 70 DGIDHN CCc1ccc(CC(=O)NCc2cccc(CN(C)C)c2)cc1 ZINC000159712894 432693350 /nfs/dbraw/zinc/69/33/50/432693350.db2.gz FERKJXFJJVUUIZ-UHFFFAOYSA-N 0 3 310.441 3.170 20 70 DGIDHN CC(C)CCOc1ccc(CN2CCC(CC(N)=O)CC2)cc1 ZINC000159806086 432697825 /nfs/dbraw/zinc/69/78/25/432697825.db2.gz NAKBOXZLLXFOCT-UHFFFAOYSA-N 0 3 318.461 3.199 20 70 DGIDHN COc1ccccc1-c1nnc(CN(C)C(C2CC2)C2CC2)o1 ZINC000159868766 432699552 /nfs/dbraw/zinc/69/95/52/432699552.db2.gz UALKZSKZCQHSLA-UHFFFAOYSA-N 0 3 313.401 3.366 20 70 DGIDHN C[C@H]1C[C@H](NC(=O)N(C)CC2CCC2)CN1Cc1ccccc1 ZINC000159914794 432700646 /nfs/dbraw/zinc/70/06/46/432700646.db2.gz BKKGCLQSNDLCSW-YJBOKZPZSA-N 0 3 315.461 3.091 20 70 DGIDHN C[C@@H]1C[C@H](NC(=O)N(C)CC2CCC2)CN1Cc1ccccc1 ZINC000159914659 432701116 /nfs/dbraw/zinc/70/11/16/432701116.db2.gz BKKGCLQSNDLCSW-QAPCUYQASA-N 0 3 315.461 3.091 20 70 DGIDHN CCCC(=O)N[C@H]1CCCN(CCCc2cccc(OC)c2)C1 ZINC000160188034 432710700 /nfs/dbraw/zinc/71/07/00/432710700.db2.gz OZTFXORXKWLSRN-KRWDZBQOSA-N 0 3 318.461 3.009 20 70 DGIDHN CCN(CC)[C@@H](CNC(=O)C1=CCCC1)c1cccc(OC)c1 ZINC000160245050 432712341 /nfs/dbraw/zinc/71/23/41/432712341.db2.gz OEVCZIHDUZTQQE-SFHVURJKSA-N 0 3 316.445 3.305 20 70 DGIDHN CCN1CCC(NC(=O)[C@@H](C)Cc2cccc(Cl)c2)CC1 ZINC000160337695 432715866 /nfs/dbraw/zinc/71/58/66/432715866.db2.gz KDUUZFXCQZCPEP-ZDUSSCGKSA-N 0 3 308.853 3.119 20 70 DGIDHN Cc1nc2n(n1)C[C@@H](N[C@@H](C)c1ccc(F)cc1Cl)CC2 ZINC000160384681 432717879 /nfs/dbraw/zinc/71/78/79/432717879.db2.gz QTIXETSGPBSYCF-CABZTGNLSA-N 0 3 308.788 3.045 20 70 DGIDHN CCN(CC1CC1)C(=O)N[C@H]1C[C@H](C)N(Cc2ccccc2)C1 ZINC000160404491 432719892 /nfs/dbraw/zinc/71/98/92/432719892.db2.gz XXAUFIUMNAUOLQ-YJBOKZPZSA-N 0 3 315.461 3.091 20 70 DGIDHN Cc1cc(Oc2ccc(NC(=O)[C@H](C(C)C)N(C)C)cc2)n[nH]1 ZINC000160460845 432720302 /nfs/dbraw/zinc/72/03/02/432720302.db2.gz VUADPXBBHOKGAH-INIZCTEOSA-N 0 3 316.405 3.035 20 70 DGIDHN CC1(C)Cc2cccc(CN[C@@H]3[C@H]4CCO[C@@H]4C34CCC4)c2O1 ZINC000159546012 432687315 /nfs/dbraw/zinc/68/73/15/432687315.db2.gz AJNYQCNWFJCNLS-NXHRZFHOSA-N 0 3 313.441 3.447 20 70 DGIDHN Cc1nn(-c2ccccc2)cc1CN[C@@H]1[C@@H]2CCO[C@@H]2C12CCC2 ZINC000159581767 432689067 /nfs/dbraw/zinc/68/90/67/432689067.db2.gz WWWBNLSHJDIMRW-OTWHNJEPSA-N 0 3 323.440 3.228 20 70 DGIDHN CC(C)(C)c1nsc(N2CC[C@H](CN3CCCCC3)C2)n1 ZINC000159673733 432691705 /nfs/dbraw/zinc/69/17/05/432691705.db2.gz ATPOLOPUMFFNAZ-CYBMUJFWSA-N 0 3 308.495 3.148 20 70 DGIDHN O[C@@H](CN1CC[C@]2(O)CCCC[C@@H]2C1)c1ccccc1Cl ZINC000161031947 432755945 /nfs/dbraw/zinc/75/59/45/432755945.db2.gz UHFWAHRSMDZRDT-XOKHGSTOSA-N 0 3 309.837 3.000 20 70 DGIDHN CC[C@H](NCCNC(=O)C(C)C)c1cccc(Cl)c1F ZINC000161496063 432782525 /nfs/dbraw/zinc/78/25/25/432782525.db2.gz KBENIMFISPCXAC-ZDUSSCGKSA-N 0 3 300.805 3.292 20 70 DGIDHN Cc1ccoc1C(=O)NCCCN[C@H](C)c1ccccc1F ZINC000161212907 432766017 /nfs/dbraw/zinc/76/60/17/432766017.db2.gz SLHCXJWULJHYKE-CYBMUJFWSA-N 0 3 304.365 3.198 20 70 DGIDHN CCN1CCCC[C@@H]1CN[C@@H](C)c1ccc(OC)cc1OC ZINC000161202259 432767298 /nfs/dbraw/zinc/76/72/98/432767298.db2.gz BUJJGQYTBDASHA-LSDHHAIUSA-N 0 3 306.450 3.229 20 70 DGIDHN C[C@@H](c1ccccc1)N1CCC(NC(=O)NC2(C)CCC2)CC1 ZINC000161315711 432773633 /nfs/dbraw/zinc/77/36/33/432773633.db2.gz CSVUUZIBRGLBDA-HNNXBMFYSA-N 0 3 315.461 3.454 20 70 DGIDHN Cc1nc2n(n1)C[C@@H](N[C@@H](C)c1ccc3c(c1)CCCC3)CC2 ZINC000160527650 432727170 /nfs/dbraw/zinc/72/71/70/432727170.db2.gz LCCQHSABNIFMNA-UGSOOPFHSA-N 0 3 310.445 3.131 20 70 DGIDHN CCCC1(CN[C@H](C(=O)NC2CC2)c2ccc(F)cc2)CC1 ZINC000160772608 432740449 /nfs/dbraw/zinc/74/04/49/432740449.db2.gz KTMRULLTFSMJGR-INIZCTEOSA-N 0 3 304.409 3.315 20 70 DGIDHN Cc1cccc(CNc2ccc(OC3CCN(C)CC3)nc2)c1 ZINC000160068908 292807026 /nfs/dbraw/zinc/80/70/26/292807026.db2.gz PVUZTLZPAYLEDP-UHFFFAOYSA-N 0 3 311.429 3.475 20 70 DGIDHN CC(C)[C@H](N)C(=O)NCC1(Sc2ccccc2)CCCC1 ZINC000159674792 519817034 /nfs/dbraw/zinc/81/70/34/519817034.db2.gz RTYYVUIROBYNBG-HNNXBMFYSA-N 0 3 306.475 3.191 20 70 DGIDHN CCOCCC1(CNC(=O)c2cccc(CN(C)C)c2)CCC1 ZINC000160410273 521690254 /nfs/dbraw/zinc/69/02/54/521690254.db2.gz HJDSKBDSECPEOK-UHFFFAOYSA-N 0 3 318.461 3.075 20 70 DGIDHN Cc1nc2ccccn2c1CN(CCO)[C@@H]1CCc2ccccc21 ZINC000160379479 527176700 /nfs/dbraw/zinc/17/67/00/527176700.db2.gz UYLHPMZUPJLJLY-GOSISDBHSA-N 0 3 321.424 3.125 20 70 DGIDHN CCN1CCCN(C(=O)N[C@H](c2ccccc2)C2CCC2)CC1 ZINC000159821326 529030617 /nfs/dbraw/zinc/03/06/17/529030617.db2.gz WBSCEYBCODJBFI-GOSISDBHSA-N 0 3 315.461 3.265 20 70 DGIDHN CCN1CCCN(C(=O)N[C@H](c2ccccc2C)C(C)C)CC1 ZINC000159853864 529031777 /nfs/dbraw/zinc/03/17/77/529031777.db2.gz LXFXPEAEERDOHF-SFHVURJKSA-N 0 3 317.477 3.429 20 70 DGIDHN Cc1nccc(NC(=O)N[C@H](C)CN2CCCCC2)c1Cl ZINC000159577042 546055413 /nfs/dbraw/zinc/05/54/13/546055413.db2.gz WFQKPTDSSYVJQG-LLVKDONJSA-N 0 3 310.829 3.039 20 70 DGIDHN c1nc(CN2CCN(c3ccncc3)CC2)oc1-c1ccccc1 ZINC000161339357 546068544 /nfs/dbraw/zinc/06/85/44/546068544.db2.gz LFOGACQYEFZLBU-UHFFFAOYSA-N 0 3 320.396 3.059 20 70 DGIDHN CC(C)CNC(=O)[C@@H](C)NCC1(c2ccccc2)CCCC1 ZINC000217578022 575908887 /nfs/dbraw/zinc/90/88/87/575908887.db2.gz KIWKJQIFXFAXIV-MRXNPFEDSA-N 0 3 302.462 3.249 20 70 DGIDHN CCN1CCCN(C(=O)N[C@H](C)c2cc3ccccc3o2)CC1 ZINC000159552553 186126757 /nfs/dbraw/zinc/12/67/57/186126757.db2.gz MEAPGHDGGSNAEQ-CQSZACIVSA-N 0 3 315.417 3.231 20 70 DGIDHN COc1ccc(CN(C)Cc2ccc(-n3cncn3)c(C)c2)cc1 ZINC000159850180 197369174 /nfs/dbraw/zinc/36/91/74/197369174.db2.gz DHOYWOYWXAIARE-UHFFFAOYSA-N 0 3 322.412 3.216 20 70 DGIDHN CCN(CCN[C@@H](C)c1cnc(C)nc1C)C(=O)OC(C)(C)C ZINC000159458064 197355068 /nfs/dbraw/zinc/35/50/68/197355068.db2.gz MGGRPCFJSUEEMJ-LBPRGKRZSA-N 0 3 322.453 3.001 20 70 DGIDHN CC[C@@H](CC(=O)N[C@@H]1CCN(CC2CC2)C1)c1ccc(C)cc1 ZINC000159490317 400730183 /nfs/dbraw/zinc/73/01/83/400730183.db2.gz YGJYLGOMRZKIPQ-PKOBYXMFSA-N 0 3 314.473 3.479 20 70 DGIDHN CC[C@H](NCCn1c2ccccc2oc1=O)c1ccc(F)cc1 ZINC000160895452 400736605 /nfs/dbraw/zinc/73/66/05/400736605.db2.gz ZLLWFFFELWHMPU-HNNXBMFYSA-N 0 3 314.360 3.475 20 70 DGIDHN C[C@@H](CSC(C)(C)C)N[C@@H](C)C(=O)NCc1ccccc1 ZINC000161194013 274229482 /nfs/dbraw/zinc/22/94/82/274229482.db2.gz WZPAXYQFZFLYER-KBPBESRZSA-N 0 3 308.491 3.201 20 70 DGIDHN Cc1nc2ccccc2c(N2CCC(n3ccnn3)CC2)c1C ZINC000160205220 282072921 /nfs/dbraw/zinc/07/29/21/282072921.db2.gz RLOAOKOPJPKFMR-UHFFFAOYSA-N 0 3 307.401 3.285 20 70 DGIDHN CCN(CC)C(=O)N(C)[C@H]1CCN(Cc2ccccc2)[C@H](C)C1 ZINC000159998364 432702889 /nfs/dbraw/zinc/70/28/89/432702889.db2.gz VXARNEANPQTFMV-AEFFLSMTSA-N 0 3 317.477 3.433 20 70 DGIDHN CCC(C)(C)NC(=O)N[C@@H]1C[C@@H](C)N(Cc2ccccc2)C1 ZINC000160291587 432713486 /nfs/dbraw/zinc/71/34/86/432713486.db2.gz FPUYKMVCEUYKQI-GDBMZVCRSA-N 0 3 303.450 3.137 20 70 DGIDHN CCC(C)(C)NC(=O)N[C@H]1C[C@H](C)N(Cc2ccccc2)C1 ZINC000160291463 432714418 /nfs/dbraw/zinc/71/44/18/432714418.db2.gz FPUYKMVCEUYKQI-HOCLYGCPSA-N 0 3 303.450 3.137 20 70 DGIDHN CC[C@@H](CN[C@H]1CCCc2c1cnn2C)Oc1ccccc1F ZINC000160338773 432715924 /nfs/dbraw/zinc/71/59/24/432715924.db2.gz YODPGMGJHRKPTC-BBRMVZONSA-N 0 3 317.408 3.384 20 70 DGIDHN Cc1nc2n(n1)C[C@@H](N[C@H](C)c1oc3ccccc3c1C)CC2 ZINC000160381697 432716948 /nfs/dbraw/zinc/71/69/48/432716948.db2.gz FPLJPYSTOVBEOU-OCCSQVGLSA-N 0 3 310.401 3.307 20 70 DGIDHN COc1ccc(CN[C@@H]2CCOC(C)(C)C2)c(Cl)c1OC ZINC000160454280 432720366 /nfs/dbraw/zinc/72/03/66/432720366.db2.gz YOMKKXFZFSRMJN-GFCCVEGCSA-N 0 3 313.825 3.404 20 70 DGIDHN CN(Cc1ccccc1)CC(C)(C)NCc1cn2ccccc2n1 ZINC000159362241 432680147 /nfs/dbraw/zinc/68/01/47/432680147.db2.gz MNLXSQBJWGSFGF-UHFFFAOYSA-N 0 3 322.456 3.335 20 70 DGIDHN CN(C)CCN(C(=O)N[C@@H]1CCc2ccccc21)C1CCCC1 ZINC000159509712 432685044 /nfs/dbraw/zinc/68/50/44/432685044.db2.gz JZQVOSWTTBDMGX-GOSISDBHSA-N 0 3 315.461 3.190 20 70 DGIDHN Cc1nc2ccc(NC(=O)c3ccc(CN(C)C)cc3)cc2o1 ZINC000159584967 432689241 /nfs/dbraw/zinc/68/92/41/432689241.db2.gz ZABZBKXEDFHLLB-UHFFFAOYSA-N 0 3 309.369 3.450 20 70 DGIDHN COc1ccc([C@H](C)NCC(=O)NC(C)C)c2ccccc12 ZINC000160929494 432749125 /nfs/dbraw/zinc/74/91/25/432749125.db2.gz WNFUOMSYCUTYRP-ZDUSSCGKSA-N 0 3 300.402 3.024 20 70 DGIDHN CC(C)NC(=O)CN[C@@H](CCc1ccccc1)c1ccccc1 ZINC000160972934 432753243 /nfs/dbraw/zinc/75/32/43/432753243.db2.gz ORMMYLDQHUYUKF-IBGZPJMESA-N 0 3 310.441 3.475 20 70 DGIDHN Cc1ccc([C@H](C)CN[C@H](C(N)=O)c2ccc(F)cc2)cc1 ZINC000161049811 432756876 /nfs/dbraw/zinc/75/68/76/432756876.db2.gz WYPKAUMNHSJAFI-DYVFJYSZSA-N 0 3 300.377 3.054 20 70 DGIDHN COc1ccc(COCCCN[C@H](C)c2cncs2)cc1 ZINC000161072258 432757286 /nfs/dbraw/zinc/75/72/86/432757286.db2.gz RTZMCOKQYWHRJI-CYBMUJFWSA-N 0 3 306.431 3.409 20 70 DGIDHN CCn1cc([C@@H](C)NCCCOCc2ccc(OC)cc2)cn1 ZINC000161086713 432758287 /nfs/dbraw/zinc/75/82/87/432758287.db2.gz CKXRLMGCMWDQJG-OAHLLOKOSA-N 0 3 317.433 3.169 20 70 DGIDHN CSCC[C@@H](N)C(=O)Nc1ccc(COC2CCCC2)cc1 ZINC000161136577 432760885 /nfs/dbraw/zinc/76/08/85/432760885.db2.gz KRLDAONZDXGZIJ-MRXNPFEDSA-N 0 3 322.474 3.165 20 70 DGIDHN C[C@H]1C[C@H](N[C@@H]2CCCOc3ccc(F)cc32)CN1C1CC1 ZINC000161266927 432769464 /nfs/dbraw/zinc/76/94/64/432769464.db2.gz UYYJIBIUNAESQS-RVSPLBMKSA-N 0 3 304.409 3.254 20 70 DGIDHN C[C@@H]1C[C@H](N[C@@H]2CCCOc3ccc(F)cc32)CN1C1CC1 ZINC000161266796 432769538 /nfs/dbraw/zinc/76/95/38/432769538.db2.gz UYYJIBIUNAESQS-HACGYAERSA-N 0 3 304.409 3.254 20 70 DGIDHN CC[C@H](C(=O)N1CCC[C@@H]2CN(C)CC[C@@H]21)c1ccc(F)cc1 ZINC000161264532 432770420 /nfs/dbraw/zinc/77/04/20/432770420.db2.gz GJCNVSYMMXTNIV-NJAFHUGGSA-N 0 3 318.436 3.262 20 70 DGIDHN C[C@@H]1CN(Cc2ccccc2)CC[C@@H]1NC(=O)[C@@H]1CC1(C)C ZINC000161348141 432774256 /nfs/dbraw/zinc/77/42/56/432774256.db2.gz GRECMTDFPABTOB-PVAVHDDUSA-N 0 3 300.446 3.059 20 70 DGIDHN CC(=O)NC1CCC(N[C@H](COCC(C)C)c2ccco2)CC1 ZINC000161393921 432776960 /nfs/dbraw/zinc/77/69/60/432776960.db2.gz QLLPWLQWNLXJMC-OFLPRAFFSA-N 0 3 322.449 3.030 20 70 DGIDHN COc1ccc(OC)c(CCN[C@@H](C)c2cnc(C)nc2C)c1 ZINC000161416434 432778230 /nfs/dbraw/zinc/77/82/30/432778230.db2.gz LKYTYNCPWLHUOR-LBPRGKRZSA-N 0 3 315.417 3.004 20 70 DGIDHN CC[C@H](C)c1cc(C(=O)NC[C@@H](C)N2CCC[C@H](C)C2)on1 ZINC000160547882 432726869 /nfs/dbraw/zinc/72/68/69/432726869.db2.gz WMTVEKHJRRBPCT-MELADBBJSA-N 0 3 307.438 3.038 20 70 DGIDHN CCCNC(=O)c1cccc(CN[C@H]2CC(C)(C)OC2(C)C)c1 ZINC000160631159 432731899 /nfs/dbraw/zinc/73/18/99/432731899.db2.gz IEVQMEURGLMFCT-INIZCTEOSA-N 0 3 318.461 3.262 20 70 DGIDHN CN(C)CCN(C(=O)N[C@H]1CCCc2occc21)C1CCCC1 ZINC000160671228 432734101 /nfs/dbraw/zinc/73/41/01/432734101.db2.gz MEISLZQSSKLLQU-INIZCTEOSA-N 0 3 319.449 3.173 20 70 DGIDHN CC[C@H](NCC(C)(C)N1CCOCC1)c1ccc(F)cc1F ZINC000160658473 432734749 /nfs/dbraw/zinc/73/47/49/432734749.db2.gz MTGLROGCBCHBSI-INIZCTEOSA-N 0 3 312.404 3.116 20 70 DGIDHN CCOc1c(CN[C@H]2CCOC(C)(C)C2)c(C)nn1CC(C)C ZINC000160452788 292814803 /nfs/dbraw/zinc/81/48/03/292814803.db2.gz DPWQSSAQWSZTRM-HNNXBMFYSA-N 0 3 323.481 3.293 20 70 DGIDHN O[C@H](C1CCN(Cc2cccc3cccnc32)CC1)C(F)(F)F ZINC000161221277 292831606 /nfs/dbraw/zinc/83/16/06/292831606.db2.gz VPNCDBGMOZSRNY-MRXNPFEDSA-N 0 3 324.346 3.370 20 70 DGIDHN O=C(NC1CCN(C2CC2)CC1)[C@@H]1CC[C@@H]2CCCC[C@@H]2C1 ZINC000161292752 292832727 /nfs/dbraw/zinc/83/27/27/292832727.db2.gz SCOVOFPIBLQGEZ-ARFHVFGLSA-N 0 3 304.478 3.336 20 70 DGIDHN C[C@@H]1CC[C@@H](C)N1C(=O)NC[C@@H](c1ccccc1)N1CCCC1 ZINC000161398973 292834459 /nfs/dbraw/zinc/83/44/59/292834459.db2.gz RBYGVIYVOVJCLE-NUJGCVRESA-N 0 3 315.461 3.406 20 70 DGIDHN C[C@@H](CSCc1ccccc1)C(=O)N1CCC[C@@H](N(C)C)C1 ZINC000161481599 534192157 /nfs/dbraw/zinc/19/21/57/534192157.db2.gz PGBPNAXFQFPSSC-DOTOQJQBSA-N 0 3 320.502 3.109 20 70 DGIDHN CSC[C@@H](CCO)N[C@@H](C)c1cccc(OC(F)(F)F)c1 ZINC000160411873 525641785 /nfs/dbraw/zinc/64/17/85/525641785.db2.gz OASULHXOQSDAPU-CMPLNLGQSA-N 0 3 323.380 3.350 20 70 DGIDHN CSC[C@H](CCO)N[C@H](C)c1ccc(OC(F)F)cc1 ZINC000160357531 525700817 /nfs/dbraw/zinc/70/08/17/525700817.db2.gz RHOQOBJPGKMULH-PWSUYJOCSA-N 0 3 305.390 3.053 20 70 DGIDHN CCN1CCCN(C(=O)N[C@@H]2CCC[C@@H]2c2ccccc2)CC1 ZINC000159851765 529029133 /nfs/dbraw/zinc/02/91/33/529029133.db2.gz NVYTZKXCJUYIIP-QZTJIDSGSA-N 0 3 315.461 3.060 20 70 DGIDHN Cc1ccccc1[C@@H](C)N[C@@H]1CCN(C(=O)C2CCCC2)C1 ZINC000159820698 546056491 /nfs/dbraw/zinc/05/64/91/546056491.db2.gz KIAAQTRSNVQFGD-NVXWUHKLSA-N 0 3 300.446 3.437 20 70 DGIDHN NC(=O)CC1CCN(Cc2cccc(-c3ccccc3)c2)CC1 ZINC000159813128 546056668 /nfs/dbraw/zinc/05/66/68/546056668.db2.gz HJBKTDJJRLCGHF-UHFFFAOYSA-N 0 3 308.425 3.441 20 70 DGIDHN CCN(C(=O)NCCC1CC1)[C@@H]1CCN(Cc2ccccc2)C1 ZINC000160442692 546060355 /nfs/dbraw/zinc/06/03/55/546060355.db2.gz AYYKZZXHAXJGJP-GOSISDBHSA-N 0 3 315.461 3.093 20 70 DGIDHN CC(C)N(CCCCS(C)(=O)=O)Cc1cccc(Cl)c1 ZINC000161466978 546069679 /nfs/dbraw/zinc/06/96/79/546069679.db2.gz LPZYXEVVJZNWEQ-UHFFFAOYSA-N 0 3 317.882 3.375 20 70 DGIDHN CC(C)CN1CCO[C@H](CN[C@@H](C)c2cccc(Cl)c2)C1 ZINC000216641432 575273479 /nfs/dbraw/zinc/27/34/79/575273479.db2.gz MMFGQDFWGQXFLQ-WMLDXEAASA-N 0 3 310.869 3.347 20 70 DGIDHN CC(C)CN1CCO[C@@H](CN[C@@H](C)c2ccc(Cl)cc2)C1 ZINC000216641502 575273505 /nfs/dbraw/zinc/27/35/05/575273505.db2.gz UYVXXNVWCMTTCB-YOEHRIQHSA-N 0 3 310.869 3.347 20 70 DGIDHN CCn1cc(C(=O)OCCN2CCCCC2)c2ccccc21 ZINC000216636842 626987708 /nfs/dbraw/zinc/98/77/08/626987708.db2.gz YPXASJPGKXFQLQ-UHFFFAOYSA-N 0 3 300.402 3.304 20 70 DGIDHN Cc1c([C@H](C)NCCC(C)(C)O)cnn1-c1ccc(F)cc1 ZINC000159571872 186127823 /nfs/dbraw/zinc/12/78/23/186127823.db2.gz ZCOTZGVXVMBZBG-LBPRGKRZSA-N 0 3 305.397 3.131 20 70 DGIDHN Cn1c(CN[C@@H]2CCOC(C)(C)C2)nc2cc(Cl)ccc21 ZINC000160564066 197422742 /nfs/dbraw/zinc/42/27/42/197422742.db2.gz FHFPLYLSPOELOP-GFCCVEGCSA-N 0 3 307.825 3.274 20 70 DGIDHN C[C@@H](NC[C@H](C)N1CCc2sccc2C1)c1cncc(F)c1 ZINC000159871939 197370204 /nfs/dbraw/zinc/37/02/04/197370204.db2.gz PAQWXWRKKUFIIX-QWHCGFSZSA-N 0 3 319.449 3.380 20 70 DGIDHN CCn1cc([C@H](C)NC[C@@H](C)N2CCc3ccccc3C2)cn1 ZINC000159816876 197366584 /nfs/dbraw/zinc/36/65/84/197366584.db2.gz HOWCXKWHLDJVHN-CVEARBPZSA-N 0 3 312.461 3.000 20 70 DGIDHN Brc1cccc(CN(CCn2ccnc2)C2CC2)c1 ZINC000159778377 197363162 /nfs/dbraw/zinc/36/31/62/197363162.db2.gz KCDZBZICQWKTDS-UHFFFAOYSA-N 0 3 320.234 3.310 20 70 DGIDHN Cc1cc(C)cc(CCC(=O)N2CCC[C@H]3CN(C)CC[C@@H]32)c1 ZINC000159766305 197362964 /nfs/dbraw/zinc/36/29/64/197362964.db2.gz TUIURURAJQJWPU-OALUTQOASA-N 0 3 314.473 3.179 20 70 DGIDHN CCN(CCN[C@@H](C)c1cncc(F)c1)C(=O)OC(C)(C)C ZINC000159496353 197357856 /nfs/dbraw/zinc/35/78/56/197357856.db2.gz YDSTZAOKNFLQDR-LBPRGKRZSA-N 0 3 311.401 3.128 20 70 DGIDHN Cc1cc(NC(=O)[C@H]2CCCCN2)ccc1OCC(F)(F)F ZINC000159563394 197361830 /nfs/dbraw/zinc/36/18/30/197361830.db2.gz WXVXLTVDBUTCIC-GFCCVEGCSA-N 0 3 316.323 3.017 20 70 DGIDHN CCN(Cc1cnc2ccccn12)[C@H](COC)Cc1ccccc1 ZINC000160926918 285125710 /nfs/dbraw/zinc/12/57/10/285125710.db2.gz HHXUCMRMXHPKDU-SFHVURJKSA-N 0 3 323.440 3.414 20 70 DGIDHN CC[C@@H](N[C@H](C)C(=O)NCc1ccco1)c1ccc(F)cc1 ZINC000160834101 400736821 /nfs/dbraw/zinc/73/68/21/400736821.db2.gz JVCHSYQWBRXOJK-MLGOLLRUSA-N 0 3 304.365 3.164 20 70 DGIDHN COc1cc(Cl)ccc1CNC(=O)[C@H](C)N1CCCCCC1 ZINC000217194251 165376648 /nfs/dbraw/zinc/37/66/48/165376648.db2.gz PLMJNHNLMQRASB-ZDUSSCGKSA-N 0 3 324.852 3.229 20 70 DGIDHN CCN(C(=O)[C@@H](C)[C@H](N)c1ccccc1)c1nc(C)cs1 ZINC000160173912 276300252 /nfs/dbraw/zinc/30/02/52/276300252.db2.gz OSKWDGCYJZHQHT-JSGCOSHPSA-N 0 3 303.431 3.141 20 70 DGIDHN CC(C)(O)CN[C@H]1CCCOc2c(Br)cccc21 ZINC000160611833 277317717 /nfs/dbraw/zinc/31/77/17/277317717.db2.gz IUKNCYORWBEUSJ-LBPRGKRZSA-N 0 3 314.223 3.023 20 70 DGIDHN CN(CCNCc1cccc2cc[nH]c21)C(=O)OC(C)(C)C ZINC000218182314 432659271 /nfs/dbraw/zinc/65/92/71/432659271.db2.gz IZWNDQKUKBYFOT-UHFFFAOYSA-N 0 3 303.406 3.124 20 70 DGIDHN CN(Cc1ccc(OC(F)(F)F)cc1)C[C@@H]1CCC[C@@H]1O ZINC000159853467 432699976 /nfs/dbraw/zinc/69/99/76/432699976.db2.gz YTWHAMXKTXKNFR-JSGCOSHPSA-N 0 3 303.324 3.178 20 70 DGIDHN CN(C)Cc1ccc(C(=O)Nc2cccc(-c3nnco3)c2)cc1 ZINC000159938146 432701207 /nfs/dbraw/zinc/70/12/07/432701207.db2.gz FJVAZJFMSBOSKP-UHFFFAOYSA-N 0 3 322.368 3.051 20 70 DGIDHN CCCN(C(=O)N[C@H]1CN(Cc2ccccc2)C[C@@H]1C)C1CC1 ZINC000159959760 432702664 /nfs/dbraw/zinc/70/26/64/432702664.db2.gz AFNNUTQBOQEDIA-YJBOKZPZSA-N 0 3 315.461 3.091 20 70 DGIDHN CC[C@@H](C(=O)N[C@@H]1CCSc2ccc(Cl)cc21)N(C)C ZINC000160094894 432706141 /nfs/dbraw/zinc/70/61/41/432706141.db2.gz CEQGTFODYHJXMB-OLZOCXBDSA-N 0 3 312.866 3.333 20 70 DGIDHN CN(C)CCN(Cc1ccccn1)C(=O)C1CCC(C)(C)CC1 ZINC000160113219 432706288 /nfs/dbraw/zinc/70/62/88/432706288.db2.gz JCRXKXYOKBRMEQ-UHFFFAOYSA-N 0 3 317.477 3.188 20 70 DGIDHN OCC1(CNCc2cc(F)cc(C(F)(F)F)c2)CCCC1 ZINC000160107130 432706825 /nfs/dbraw/zinc/70/68/25/432706825.db2.gz UYNRPSNFBRHFJR-UHFFFAOYSA-N 0 3 305.315 3.487 20 70 DGIDHN CC1(NC(=O)NC[C@H]2CCCN(Cc3cccs3)C2)CCC1 ZINC000160325955 432713558 /nfs/dbraw/zinc/71/35/58/432713558.db2.gz DAKANJRGPNIBIK-CQSZACIVSA-N 0 3 321.490 3.202 20 70 DGIDHN Cc1nc2n(n1)C[C@H](N[C@H](C)c1oc3ccccc3c1C)CC2 ZINC000160381423 432716861 /nfs/dbraw/zinc/71/68/61/432716861.db2.gz FPLJPYSTOVBEOU-TZMCWYRMSA-N 0 3 310.401 3.307 20 70 DGIDHN Cc1nc2n(n1)C[C@H](N[C@@H](C)c1oc3ccccc3c1C)CC2 ZINC000160381562 432717582 /nfs/dbraw/zinc/71/75/82/432717582.db2.gz FPLJPYSTOVBEOU-GXTWGEPZSA-N 0 3 310.401 3.307 20 70 DGIDHN COc1cccc(CN(CCOCC2CC2)C[C@H]2CCCO2)c1 ZINC000159654573 432691411 /nfs/dbraw/zinc/69/14/11/432691411.db2.gz RLCAWWLFXPGQNH-LJQANCHMSA-N 0 3 319.445 3.103 20 70 DGIDHN Cc1cc(C)c(C(=O)NC[C@H](c2cccs2)N2CCCC2)[nH]1 ZINC000159671182 432691419 /nfs/dbraw/zinc/69/14/19/432691419.db2.gz KVOYXCOAFXRCSP-CQSZACIVSA-N 0 3 317.458 3.260 20 70 DGIDHN C[C@H](CN[C@H](C)c1cncc(F)c1)N(C)Cc1ccccc1 ZINC000160882008 432747307 /nfs/dbraw/zinc/74/73/07/432747307.db2.gz VTJKOIFPDVZBBQ-HUUCEWRRSA-N 0 3 301.409 3.392 20 70 DGIDHN C[C@@H](NC[C@H](C)N(C)Cc1ccccc1)c1cncc(F)c1 ZINC000160881882 432747917 /nfs/dbraw/zinc/74/79/17/432747917.db2.gz VTJKOIFPDVZBBQ-LSDHHAIUSA-N 0 3 301.409 3.392 20 70 DGIDHN C/C=C/COc1ccc(CC[C@@H](C)NCC(=O)NC(C)C)cc1 ZINC000160946233 432751366 /nfs/dbraw/zinc/75/13/66/432751366.db2.gz UAZGBBZSJGTPSN-SQRWCISFSA-N 0 3 318.461 3.077 20 70 DGIDHN CC(C)NC(=O)CN[C@H](CCc1ccccc1)c1ccccc1 ZINC000160973043 432752048 /nfs/dbraw/zinc/75/20/48/432752048.db2.gz ORMMYLDQHUYUKF-LJQANCHMSA-N 0 3 310.441 3.475 20 70 DGIDHN CCO[C@H]1C[C@@H](N(C)Cc2c(C)nc3ccccn32)C1(C)C ZINC000160570680 432728829 /nfs/dbraw/zinc/72/88/29/432728829.db2.gz LTWWPPFESDDMBT-CVEARBPZSA-N 0 3 301.434 3.278 20 70 DGIDHN Cc1c([C@@H](C)NCC(C)(C)O)cnn1-c1cccc(Cl)c1 ZINC000160588420 432731028 /nfs/dbraw/zinc/73/10/28/432731028.db2.gz IUJZOBZDOJLIIO-LLVKDONJSA-N 0 3 307.825 3.256 20 70 DGIDHN Fc1cc(Cl)ccc1CNC[C@H]1CCN(CC(F)(F)F)C1 ZINC000160767004 432740573 /nfs/dbraw/zinc/74/05/73/432740573.db2.gz PGWSGBMZWMNRTQ-SNVBAGLBSA-N 0 3 324.749 3.453 20 70 DGIDHN CN1CC[C@H]2[C@@H](CCCN2C(=O)CCCSC(C)(C)C)C1 ZINC000160768476 432741371 /nfs/dbraw/zinc/74/13/71/432741371.db2.gz KKVLVVLIFJCUDU-GJZGRUSLSA-N 0 3 312.523 3.241 20 70 DGIDHN CC[C@H](NCCNC(=O)c1ccccc1F)c1ccc(F)cc1 ZINC000160810241 432742103 /nfs/dbraw/zinc/74/21/03/432742103.db2.gz KEKRNQREPJAQGL-KRWDZBQOSA-N 0 3 318.367 3.436 20 70 DGIDHN COc1ccccc1C[C@@H](C)N(C)Cc1cnc2ccccn12 ZINC000160816059 432744812 /nfs/dbraw/zinc/74/48/12/432744812.db2.gz MQCXIZCVFXYEHK-OAHLLOKOSA-N 0 3 309.413 3.406 20 70 DGIDHN CN(C)Cc1ccc(C(=O)Nc2ccc(-n3cccn3)cc2)cc1 ZINC000160027643 292805786 /nfs/dbraw/zinc/80/57/86/292805786.db2.gz NDJPUTGKFNUSMF-UHFFFAOYSA-N 0 3 320.396 3.186 20 70 DGIDHN CC[C@H](C(=O)N1CCC(CCc2ccccc2)CC1)N(C)C ZINC000160728850 292821301 /nfs/dbraw/zinc/82/13/01/292821301.db2.gz UBYVZLNAMLCLMX-GOSISDBHSA-N 0 3 302.462 3.198 20 70 DGIDHN CCCNC(=O)C1(NCc2cccc3cc[nH]c32)CCCCC1 ZINC000161041221 292826761 /nfs/dbraw/zinc/82/67/61/292826761.db2.gz IEVLSEKYRVBGJQ-UHFFFAOYSA-N 0 3 313.445 3.487 20 70 DGIDHN Cc1ccc(NC(=O)c2cccc3[nH]cnc32)c(CN(C)C)c1 ZINC000159541831 534191729 /nfs/dbraw/zinc/19/17/29/534191729.db2.gz WSGIHPUIABAHSH-UHFFFAOYSA-N 0 3 308.385 3.185 20 70 DGIDHN Cc1ccc(NC(=O)c2cccc3nc[nH]c32)c(CN(C)C)c1 ZINC000159541831 534191732 /nfs/dbraw/zinc/19/17/32/534191732.db2.gz WSGIHPUIABAHSH-UHFFFAOYSA-N 0 3 308.385 3.185 20 70 DGIDHN CSC[C@@H](CCO)N[C@H](C)c1ccc(OC(F)F)cc1 ZINC000160357769 525641078 /nfs/dbraw/zinc/64/10/78/525641078.db2.gz RHOQOBJPGKMULH-ZYHUDNBSSA-N 0 3 305.390 3.053 20 70 DGIDHN CSC[C@@H](CCO)N[C@@H](C)c1cccc(C(F)(F)F)c1 ZINC000160316783 525641389 /nfs/dbraw/zinc/64/13/89/525641389.db2.gz KBLZFSRDIHVYRE-GXFFZTMASA-N 0 3 307.381 3.470 20 70 DGIDHN CCN1CCCN(C(=O)NCCCc2ccc(Cl)cc2)CC1 ZINC000159789912 529025855 /nfs/dbraw/zinc/02/58/55/529025855.db2.gz BNJHVVCSSFAZBL-UHFFFAOYSA-N 0 3 323.868 3.010 20 70 DGIDHN COc1cc(CN[C@H]2CCCOC2)ccc1OC1CCCC1 ZINC000160288973 546059101 /nfs/dbraw/zinc/05/91/01/546059101.db2.gz RFQLWTMFUBUCFZ-HNNXBMFYSA-N 0 3 305.418 3.285 20 70 DGIDHN CC1(C)CC[C@H](N[C@@H]2CCS(=O)(=O)c3ccc(F)cc32)C1 ZINC000160188507 546059134 /nfs/dbraw/zinc/05/91/34/546059134.db2.gz HFLIPCVJTQPIEQ-GXTWGEPZSA-N 0 3 311.422 3.213 20 70 DGIDHN Fc1ccccc1SCCN1CCN(c2ccncc2)CC1 ZINC000161343845 546068293 /nfs/dbraw/zinc/06/82/93/546068293.db2.gz GSMNYAUDMBXUNN-UHFFFAOYSA-N 0 3 317.433 3.135 20 70 DGIDHN Cc1nc2n(n1)C[C@H](N[C@@H](C)c1ccc3c(c1)CCCC3)CC2 ZINC000160527528 282125624 /nfs/dbraw/zinc/12/56/24/282125624.db2.gz LCCQHSABNIFMNA-SCLBCKFNSA-N 0 3 310.445 3.131 20 70 DGIDHN CCc1ccc([C@@H](C)NC(=O)N2CCCN(CC)CC2)cc1 ZINC000159531462 529705386 /nfs/dbraw/zinc/70/53/86/529705386.db2.gz WCZDOMYPWIZFNN-OAHLLOKOSA-N 0 3 303.450 3.047 20 70 DGIDHN CC1(C)C[C@H](NCc2c(F)cccc2N2CCCC2)CCO1 ZINC000160489319 197415859 /nfs/dbraw/zinc/41/58/59/197415859.db2.gz GXRWDKMKQBTVQK-CQSZACIVSA-N 0 3 306.425 3.473 20 70 DGIDHN CCN(C(=O)[C@@H](C)[C@@H](N)c1ccccc1)c1nc(C)cs1 ZINC000160174125 197391125 /nfs/dbraw/zinc/39/11/25/197391125.db2.gz OSKWDGCYJZHQHT-GXTWGEPZSA-N 0 3 303.431 3.141 20 70 DGIDHN C[C@H](NC[C@](C)(O)c1ccsc1)c1ccc([S@@](C)=O)cc1 ZINC000160037026 197380635 /nfs/dbraw/zinc/38/06/35/197380635.db2.gz OHPZMLYWNDMUJE-SAZGQGMLSA-N 0 3 323.483 3.044 20 70 DGIDHN CCN(CCN[C@H](C)c1cncc(F)c1)C(=O)OC(C)(C)C ZINC000159496488 197358055 /nfs/dbraw/zinc/35/80/55/197358055.db2.gz YDSTZAOKNFLQDR-GFCCVEGCSA-N 0 3 311.401 3.128 20 70 DGIDHN O=C(N[C@@H]1CCN(CC2CC2)C1)N(CC1CC1)C1CCCCC1 ZINC000160753381 400735883 /nfs/dbraw/zinc/73/58/83/400735883.db2.gz SKUJFLKGPLQCOB-QGZVFWFLSA-N 0 3 319.493 3.225 20 70 DGIDHN C[C@H](CNC(=O)NCC(C)(C)Cc1ccccc1)N(C)C1CC1 ZINC000217229871 165378329 /nfs/dbraw/zinc/37/83/29/165378329.db2.gz DATYBULWZAFODC-OAHLLOKOSA-N 0 3 317.477 3.037 20 70 DGIDHN CCN(CC)C(=O)C[C@H](C)N[C@H]1CCOc2c(Cl)cccc21 ZINC000161289606 276090881 /nfs/dbraw/zinc/09/08/81/276090881.db2.gz PHTATFVWLJISKH-WFASDCNBSA-N 0 3 324.852 3.400 20 70 DGIDHN Cc1ncc([C@H](C)NC[C@H](C)N2CCc3ccccc3C2)c(C)n1 ZINC000159805526 432697074 /nfs/dbraw/zinc/69/70/74/432697074.db2.gz QYDYHAIRVUPTJB-GJZGRUSLSA-N 0 3 324.472 3.191 20 70 DGIDHN CN(Cc1cc(F)cc(Br)c1)C[C@H]1CCC[C@@H]1O ZINC000159867027 432700046 /nfs/dbraw/zinc/70/00/46/432700046.db2.gz BPMHILPZBAFRCI-RISCZKNCSA-N 0 3 316.214 3.181 20 70 DGIDHN CC(C)CSCCCN[C@@H](C(=O)NC1CC1)c1ccccc1 ZINC000160028346 432705104 /nfs/dbraw/zinc/70/51/04/432705104.db2.gz PBRUHLUZOIVNBZ-QGZVFWFLSA-N 0 3 320.502 3.375 20 70 DGIDHN O=C(NCCN1CCCCCC1)[C@H]1C[C@H]1c1cccc(F)c1F ZINC000160220211 432711711 /nfs/dbraw/zinc/71/17/11/432711711.db2.gz KSFXZKFAKALJHD-GJZGRUSLSA-N 0 3 322.399 3.061 20 70 DGIDHN CC1(C)Cc2cccc(CN[C@@H]3[C@@H]4CCO[C@@H]4C34CCC4)c2O1 ZINC000159545735 432686843 /nfs/dbraw/zinc/68/68/43/432686843.db2.gz AJNYQCNWFJCNLS-JQHSSLGASA-N 0 3 313.441 3.447 20 70 DGIDHN FC(F)(F)COCCCN1CCN(CCC2CCCC2)CC1 ZINC000159607054 432688027 /nfs/dbraw/zinc/68/80/27/432688027.db2.gz YKUNSJZGIZQQLI-UHFFFAOYSA-N 0 3 322.415 3.153 20 70 DGIDHN C[C@H](Cc1ccccc1F)NC(=O)c1ccc(CN(C)C)cc1 ZINC000160918153 432749485 /nfs/dbraw/zinc/74/94/85/432749485.db2.gz CNFQKDWBUIJYNF-CQSZACIVSA-N 0 3 314.404 3.248 20 70 DGIDHN C[C@@H](C(=O)N[C@@H]1CCOC2(CCCCC2)C1)N1[C@H](C)CC[C@H]1C ZINC000161025223 432754096 /nfs/dbraw/zinc/75/40/96/432754096.db2.gz IUICYORXZPPWEH-WCXIOVBPSA-N 0 3 322.493 3.246 20 70 DGIDHN C[C@@H](C(=O)N[C@@H]1CCOC2(CCCCC2)C1)N1[C@@H](C)CC[C@@H]1C ZINC000161025080 432754869 /nfs/dbraw/zinc/75/48/69/432754869.db2.gz IUICYORXZPPWEH-LUKYLMHMSA-N 0 3 322.493 3.246 20 70 DGIDHN CC[C@@H](C(=O)NCC1(c2ccc(Cl)cc2)CCC1)N(C)C ZINC000161152020 432763185 /nfs/dbraw/zinc/76/31/85/432763185.db2.gz VMMRSBZLLBIKSA-HNNXBMFYSA-N 0 3 308.853 3.218 20 70 DGIDHN C[C@H](c1ccncc1)N(C)CC1CCN(C(=O)C(C)(C)C)CC1 ZINC000161187359 432764347 /nfs/dbraw/zinc/76/43/47/432764347.db2.gz MHFUCXWPGIVHRO-OAHLLOKOSA-N 0 3 317.477 3.359 20 70 DGIDHN Cc1ccoc1C(=O)NCCCN[C@H](C)c1cc(F)ccc1F ZINC000161213176 432767253 /nfs/dbraw/zinc/76/72/53/432767253.db2.gz XMTOOWCWUVYNKM-GFCCVEGCSA-N 0 3 322.355 3.337 20 70 DGIDHN CCCn1ccc2ccc(NC(=O)[C@H](N)CCSC)cc21 ZINC000161282503 432771321 /nfs/dbraw/zinc/77/13/21/432771321.db2.gz WNIXMRQMTADJKO-CQSZACIVSA-N 0 3 305.447 3.070 20 70 DGIDHN C[C@@H](Cc1cccc(Cl)c1)C(=O)NC1CCN(C2CC2)CC1 ZINC000161293770 432771853 /nfs/dbraw/zinc/77/18/53/432771853.db2.gz ZXJNYZXBGZQSEQ-ZDUSSCGKSA-N 0 3 320.864 3.262 20 70 DGIDHN C[C@H](c1ccccc1)N1CCC(NC(=O)NC2(C)CCC2)CC1 ZINC000161315827 432772648 /nfs/dbraw/zinc/77/26/48/432772648.db2.gz CSVUUZIBRGLBDA-OAHLLOKOSA-N 0 3 315.461 3.454 20 70 DGIDHN Cc1ccccc1OCCN[C@@H](C)c1ccc([S@@](C)=O)cc1 ZINC000161351528 432775202 /nfs/dbraw/zinc/77/52/02/432775202.db2.gz LLQHPPURTSXDCL-NYHFZMIOSA-N 0 3 317.454 3.462 20 70 DGIDHN Clc1ccccc1CN1CCC[C@@H](c2nnc3n2CCC3)C1 ZINC000161407964 432778664 /nfs/dbraw/zinc/77/86/64/432778664.db2.gz HVPPPHBVXSVYIS-CQSZACIVSA-N 0 3 316.836 3.257 20 70 DGIDHN CC[C@@H](C)CN(CC)[C@@H](C)C(=O)Nc1ccc(OC)c(OC)c1 ZINC000160537445 432727143 /nfs/dbraw/zinc/72/71/43/432727143.db2.gz JHCUPODBUMZGHB-KGLIPLIRSA-N 0 3 322.449 3.399 20 70 DGIDHN CC1(C)C[C@@H](NCc2cc(O)ccc2Br)CCO1 ZINC000160549428 432727196 /nfs/dbraw/zinc/72/71/96/432727196.db2.gz HGVJCGZHHFFQOR-NSHDSACASA-N 0 3 314.223 3.202 20 70 DGIDHN Cc1c([C@@H](C)NCC(C)(C)O)cnn1-c1cc(C)ccc1C ZINC000160590092 432730942 /nfs/dbraw/zinc/73/09/42/432730942.db2.gz RFMLLNRWPCGNDI-CQSZACIVSA-N 0 3 301.434 3.219 20 70 DGIDHN CC[C@H](NCc1cccc(C(=O)NC)c1)c1ccc(F)cc1 ZINC000160725098 432738037 /nfs/dbraw/zinc/73/80/37/432738037.db2.gz UHGNSOUUHQXRNR-KRWDZBQOSA-N 0 3 300.377 3.426 20 70 DGIDHN CC(C)N(C)CC(=O)NCCCOc1ccc2ccccc2c1 ZINC000160736279 432738528 /nfs/dbraw/zinc/73/85/28/432738528.db2.gz GFLXZRFFXSLBRA-UHFFFAOYSA-N 0 3 314.429 3.065 20 70 DGIDHN CN1CC[C@@H]2[C@H](CCCN2C(=O)CCCSC(C)(C)C)C1 ZINC000160768887 432741243 /nfs/dbraw/zinc/74/12/43/432741243.db2.gz KKVLVVLIFJCUDU-HUUCEWRRSA-N 0 3 312.523 3.241 20 70 DGIDHN CC[C@H](C)N(C)C(=O)N[C@H]1C[C@H](C)N(Cc2ccccc2)C1 ZINC000160320499 523912639 /nfs/dbraw/zinc/91/26/39/523912639.db2.gz LODCJWSQPAUUFN-ZOBUZTSGSA-N 0 3 303.450 3.089 20 70 DGIDHN CC(C)c1ccc(C(=O)NC[C@H](c2ccccc2)N(C)C)cn1 ZINC000159701631 528073009 /nfs/dbraw/zinc/07/30/09/528073009.db2.gz SZJDKWUNVINVTQ-GOSISDBHSA-N 0 3 311.429 3.238 20 70 DGIDHN C[C@H](CC(=O)N1CCC[C@@H]1CN1CCCCC1)c1ccncc1 ZINC000159909280 546057544 /nfs/dbraw/zinc/05/75/44/546057544.db2.gz BFDPOHZMSRVQBV-SJLPKXTDSA-N 0 3 315.461 3.052 20 70 DGIDHN CCN(CCCCS(C)(=O)=O)[C@H](C)c1ccc(F)cc1 ZINC000161486023 546069301 /nfs/dbraw/zinc/06/93/01/546069301.db2.gz KOQAYJYROUKCOE-CYBMUJFWSA-N 0 3 301.427 3.033 20 70 DGIDHN CC(C)Oc1ccccc1CNCCNC(=O)OC(C)(C)C ZINC000218123626 627104004 /nfs/dbraw/zinc/10/40/04/627104004.db2.gz SAWHHAMOASJCME-UHFFFAOYSA-N 0 3 308.422 3.088 20 70 DGIDHN CCc1cc(N2CCC(n3ccnn3)CC2)c2ccccc2n1 ZINC000160197655 197392454 /nfs/dbraw/zinc/39/24/54/197392454.db2.gz HHIDROHGQRJHSC-UHFFFAOYSA-N 0 3 307.401 3.230 20 70 DGIDHN CC(C)(C)c1nsc(N2CC[C@H]3[C@H](CCCN3C3CC3)C2)n1 ZINC000160044084 197381958 /nfs/dbraw/zinc/38/19/58/197381958.db2.gz YZDJXYFLLJUCAH-OCCSQVGLSA-N 0 3 320.506 3.289 20 70 DGIDHN COc1ccc2c(c1)[C@@H](NC[C@](C)(O)c1ccsc1)CC2 ZINC000159945285 197376361 /nfs/dbraw/zinc/37/63/61/197376361.db2.gz URRUQPIJMMNQQC-IRXDYDNUSA-N 0 3 303.427 3.241 20 70 DGIDHN C[C@@H](NC[C@H](C)N1CCc2sccc2C1)c1cncs1 ZINC000159856315 197369106 /nfs/dbraw/zinc/36/91/06/197369106.db2.gz IUWVQNPYLJZYHO-NWDGAFQWSA-N 0 3 307.488 3.302 20 70 DGIDHN CCn1cc([C@H](C)NC[C@H](C)N2CCc3ccccc3C2)cn1 ZINC000159817136 197366384 /nfs/dbraw/zinc/36/63/84/197366384.db2.gz HOWCXKWHLDJVHN-HOTGVXAUSA-N 0 3 312.461 3.000 20 70 DGIDHN CCCCCOc1ccc(CN2CCC(CC(N)=O)CC2)cc1 ZINC000159806623 197365492 /nfs/dbraw/zinc/36/54/92/197365492.db2.gz UWAMEVVQODSXBH-UHFFFAOYSA-N 0 3 318.461 3.343 20 70 DGIDHN Cc1ccccc1[C@@H](C)NCc1ccccc1CS(C)(=O)=O ZINC000159764697 197362905 /nfs/dbraw/zinc/36/29/05/197362905.db2.gz CFHAEYJHZNCIIA-OAHLLOKOSA-N 0 3 317.454 3.390 20 70 DGIDHN COc1cccc(CCCN2CCC(c3nc(C)no3)CC2)c1 ZINC000159494249 197358253 /nfs/dbraw/zinc/35/82/53/197358253.db2.gz UMCFKZSOIULPLA-UHFFFAOYSA-N 0 3 315.417 3.199 20 70 DGIDHN CN1CCC[C@@H](CNC(=O)C2(c3cccs3)CCCCC2)C1 ZINC000159511408 400730288 /nfs/dbraw/zinc/73/02/88/400730288.db2.gz NUHWIJIJJSABRZ-HNNXBMFYSA-N 0 3 320.502 3.408 20 70 DGIDHN CCOCCCN1CCC(c2nc(-c3ccccc3)no2)CC1 ZINC000160587964 400734484 /nfs/dbraw/zinc/73/44/84/400734484.db2.gz BTBCSPLNMIRSGM-UHFFFAOYSA-N 0 3 315.417 3.343 20 70 DGIDHN COc1ccc2c(c1)[C@@H](NC[C@H]1CCCC[C@@H]1O)CCCO2 ZINC000160467459 286424313 /nfs/dbraw/zinc/42/43/13/286424313.db2.gz SYJYVUGJBZWZAX-COXVUDFISA-N 0 3 305.418 3.050 20 70 DGIDHN C[C@@H](c1ccc(Cl)c(Cl)c1)N(C)CCN1CCOCC1 ZINC000217137988 165375552 /nfs/dbraw/zinc/37/55/52/165375552.db2.gz AVUBHXRTYHYJMD-LBPRGKRZSA-N 0 3 317.260 3.318 20 70 DGIDHN c1cc2c(c([C@H]3CCCN3CCOCC3CC3)c1)OCCO2 ZINC000160398057 228246218 /nfs/dbraw/zinc/24/62/18/228246218.db2.gz ZCRMUEVSGYVSKG-MRXNPFEDSA-N 0 3 303.402 3.021 20 70 DGIDHN C[C@@H](NCc1ccoc1)[C@H]1CCCN(C(=O)OC(C)(C)C)C1 ZINC000218175905 432658828 /nfs/dbraw/zinc/65/88/28/432658828.db2.gz GFYVISCCQOWFAM-HIFRSBDPSA-N 0 3 308.422 3.405 20 70 DGIDHN CN(CCOc1cccc(Cl)c1)C[C@@H](O)Cc1ccccc1 ZINC000218763138 432660563 /nfs/dbraw/zinc/66/05/63/432660563.db2.gz QOYVQXFVIKYLBG-KRWDZBQOSA-N 0 3 319.832 3.254 20 70 DGIDHN CC[C@H](C)c1cc(C(=O)NCc2cccc(CN(C)C)c2)on1 ZINC000159719173 432693493 /nfs/dbraw/zinc/69/34/93/432693493.db2.gz IMFADCWXZMQSGA-ZDUSSCGKSA-N 0 3 315.417 3.180 20 70 DGIDHN CN1CCC(Oc2ccc(NCc3cccc(F)c3)cn2)CC1 ZINC000160138674 432709107 /nfs/dbraw/zinc/70/91/07/432709107.db2.gz LYQMAJUMAZHGDN-UHFFFAOYSA-N 0 3 315.392 3.306 20 70 DGIDHN CSC[C@H](CCO)N[C@@H](C)c1ccccc1OC(F)(F)F ZINC000160186983 432709807 /nfs/dbraw/zinc/70/98/07/432709807.db2.gz QUCSLCYEYUALEG-QWRGUYRKSA-N 0 3 323.380 3.350 20 70 DGIDHN CCC(C)(C)NC(=O)N[C@@H]1C[C@H](C)N(Cc2ccccc2)C1 ZINC000160291325 432713171 /nfs/dbraw/zinc/71/31/71/432713171.db2.gz FPUYKMVCEUYKQI-GOEBONIOSA-N 0 3 303.450 3.137 20 70 DGIDHN CCCO[C@H]1CCCN(Cc2c(C)nc3ccccn32)CC1 ZINC000160276591 432713808 /nfs/dbraw/zinc/71/38/08/432713808.db2.gz LNGSONAGRYZBRP-INIZCTEOSA-N 0 3 301.434 3.424 20 70 DGIDHN Fc1ccccc1-c1cnc(CN2CC[C@H](N3CCCC3)C2)o1 ZINC000160335595 432715627 /nfs/dbraw/zinc/71/56/27/432715627.db2.gz PDTPSZVCWNSLDS-AWEZNQCLSA-N 0 3 315.392 3.151 20 70 DGIDHN COc1cc([C@@H](C)N[C@@H](CCO)CSC)ccc1SC ZINC000160334193 432715693 /nfs/dbraw/zinc/71/56/93/432715693.db2.gz MLBFNOMOSQOSJY-YPMHNXCESA-N 0 3 315.504 3.182 20 70 DGIDHN COC(=O)COc1cccc(CN[C@H](C)c2ccccc2C)c1 ZINC000159642305 432690107 /nfs/dbraw/zinc/69/01/07/432690107.db2.gz KQKACTLZVORWDQ-OAHLLOKOSA-N 0 3 313.397 3.398 20 70 DGIDHN COc1ccc([C@@H](C)NCC(=O)NC(C)C)c2ccccc12 ZINC000160929661 432750086 /nfs/dbraw/zinc/75/00/86/432750086.db2.gz WNFUOMSYCUTYRP-CYBMUJFWSA-N 0 3 300.402 3.024 20 70 DGIDHN CC[C@@H](NCC(=O)NCc1ccc(OC)cc1)c1cccs1 ZINC000160978886 432753224 /nfs/dbraw/zinc/75/32/24/432753224.db2.gz RVMLWWOUEBUDCI-OAHLLOKOSA-N 0 3 318.442 3.114 20 70 DGIDHN Cc1ccc([C@H](C)CN[C@@H](C(N)=O)c2ccc(F)cc2)cc1 ZINC000161050061 432755662 /nfs/dbraw/zinc/75/56/62/432755662.db2.gz WYPKAUMNHSJAFI-CXAGYDPISA-N 0 3 300.377 3.054 20 70 DGIDHN CC[C@@H](C(=O)N1CC=C(c2c[nH]c3ccccc32)CC1)N(C)C ZINC000161049084 432756507 /nfs/dbraw/zinc/75/65/07/432756507.db2.gz OEYKNASVJMPMPN-SFHVURJKSA-N 0 3 311.429 3.124 20 70 DGIDHN O=C(NC[C@@H](Cc1ccccc1)c1ccccc1)[C@H]1CCCCN1 ZINC000161071878 432757346 /nfs/dbraw/zinc/75/73/46/432757346.db2.gz SXSAZWQBZVUFRM-WOJBJXKFSA-N 0 3 322.452 3.271 20 70 DGIDHN C[C@H](N[C@H](CCO)c1ccccc1)c1ccc(-n2cncn2)cc1 ZINC000161095993 432759008 /nfs/dbraw/zinc/75/90/08/432759008.db2.gz WVVUCKDMQSVDGX-HNAYVOBHSA-N 0 3 322.412 3.042 20 70 DGIDHN CC1(C)CC(NC(=O)Cc2ccc([O-])cc2Cl)CC(C)(C)[NH2+]1 ZINC000161133353 432760819 /nfs/dbraw/zinc/76/08/19/432760819.db2.gz APQYKOADUCDTJV-UHFFFAOYSA-N 0 3 324.852 3.014 20 70 DGIDHN C[C@H](Cc1cccc(Cl)c1)C(=O)NC1CCN(C2CC2)CC1 ZINC000161293862 432772144 /nfs/dbraw/zinc/77/21/44/432772144.db2.gz ZXJNYZXBGZQSEQ-CYBMUJFWSA-N 0 3 320.864 3.262 20 70 DGIDHN CSCC[C@@H](N)C(=O)Nc1ccc(OCCC(C)C)cc1 ZINC000161382930 432776323 /nfs/dbraw/zinc/77/63/23/432776323.db2.gz KSIJMNMHCZSRMK-OAHLLOKOSA-N 0 3 310.463 3.130 20 70 DGIDHN CC[C@@H](C(=O)N1CC[C@H]2CC[C@@H](C1)N2C)c1ccc(F)cc1 ZINC000160638295 432731798 /nfs/dbraw/zinc/73/17/98/432731798.db2.gz OOTNDTLAEVZVFR-IXDOHACOSA-N 0 3 304.409 3.014 20 70 DGIDHN Cc1ccccc1[C@H](C)N[C@H](C)C(=O)NCCc1ccccc1 ZINC000159419253 292792496 /nfs/dbraw/zinc/79/24/96/292792496.db2.gz OXPUMWQFWCJERZ-DLBZAZTESA-N 0 3 310.441 3.393 20 70 DGIDHN CC(C)[C@@H](N)C(=O)NCC1(Sc2ccccc2)CCCC1 ZINC000159674896 292798004 /nfs/dbraw/zinc/79/80/04/292798004.db2.gz RTYYVUIROBYNBG-OAHLLOKOSA-N 0 3 306.475 3.191 20 70 DGIDHN C[C@H](NCC(=O)NCc1ccccc1)C(C)(C)c1ccccc1 ZINC000160073171 292806941 /nfs/dbraw/zinc/80/69/41/292806941.db2.gz QQTQMPOMPWNIIH-INIZCTEOSA-N 0 3 310.441 3.259 20 70 DGIDHN C[C@@H](Cc1ccccc1F)C(=O)N(CCN(C)C)C1CCCC1 ZINC000160058977 292806286 /nfs/dbraw/zinc/80/62/86/292806286.db2.gz ILHHJIYZUAOHEM-HNNXBMFYSA-N 0 3 320.452 3.337 20 70 DGIDHN CN1CCC(Oc2ccc(NCc3ccsc3)cn2)CC1 ZINC000160154526 292809012 /nfs/dbraw/zinc/80/90/12/292809012.db2.gz BZYFVSZMJOZLES-UHFFFAOYSA-N 0 3 303.431 3.228 20 70 DGIDHN COc1cc(CN[C@@H](C)CC(F)(F)F)cc(OC)c1OC ZINC000160664879 533889354 /nfs/dbraw/zinc/88/93/54/533889354.db2.gz NUDGJSDIEZMPDF-VIFPVBQESA-N 0 3 307.312 3.143 20 70 DGIDHN C[C@@H](CSCc1ccccc1)C(=O)N1CCC[C@H](N(C)C)C1 ZINC000161481332 534191993 /nfs/dbraw/zinc/19/19/93/534191993.db2.gz PGBPNAXFQFPSSC-RDJZCZTQSA-N 0 3 320.502 3.109 20 70 DGIDHN C[C@@H](C1CC1)N(C)C(=O)N[C@@H]1C[C@@H](C)N(Cc2ccccc2)C1 ZINC000160390906 524315360 /nfs/dbraw/zinc/31/53/60/524315360.db2.gz QFFMYOGZDVKNPQ-RVKKMQEKSA-N 0 3 315.461 3.089 20 70 DGIDHN C[C@@H](C1CC1)N(C)C(=O)N[C@H]1C[C@@H](C)N(Cc2ccccc2)C1 ZINC000160390655 524318458 /nfs/dbraw/zinc/31/84/58/524318458.db2.gz QFFMYOGZDVKNPQ-VKJFTORMSA-N 0 3 315.461 3.089 20 70 DGIDHN CCOc1cc2c(cc1CN[C@H]1CCOC(C)(C)C1)O[C@@H](C)C2 ZINC000160535488 546060985 /nfs/dbraw/zinc/06/09/85/546060985.db2.gz LYUJXKYJZQEUGQ-BBRMVZONSA-N 0 3 319.445 3.456 20 70 DGIDHN CCN(CCCCS(C)(=O)=O)[C@@H](C)c1ccc(F)cc1 ZINC000161485898 546069381 /nfs/dbraw/zinc/06/93/81/546069381.db2.gz KOQAYJYROUKCOE-ZDUSSCGKSA-N 0 3 301.427 3.033 20 70 DGIDHN Cc1nc2n(n1)C[C@@H](N[C@H](C)c1cc(C)c(F)c(C)c1)CC2 ZINC000160569633 282118770 /nfs/dbraw/zinc/11/87/70/282118770.db2.gz ONMQXWIIYUHQSE-DOMZBBRYSA-N 0 3 302.397 3.008 20 70 DGIDHN CN(Cc1cccc(OCC(F)(F)F)c1)C[C@H]1CCC[C@@H]1O ZINC000159584374 186128828 /nfs/dbraw/zinc/12/88/28/186128828.db2.gz WYXWBGIGDUWXMT-HIFRSBDPSA-N 0 3 317.351 3.221 20 70 DGIDHN C[C@@H](N[C@H]1CCCSC1)c1cnn(Cc2ccccc2)c1 ZINC000159624395 186131278 /nfs/dbraw/zinc/13/12/78/186131278.db2.gz FIRHHTLJDPRPBC-PBHICJAKSA-N 0 3 301.459 3.478 20 70 DGIDHN CC(=O)NC1CCC(N[C@@H](COCC(C)C)c2ccco2)CC1 ZINC000161393769 197491679 /nfs/dbraw/zinc/49/16/79/197491679.db2.gz QLLPWLQWNLXJMC-JCYILVPMSA-N 0 3 322.449 3.030 20 70 DGIDHN CC[C@@H](CN[C@@H](CC)c1cnn(C)c1)Oc1ccccc1F ZINC000160304209 197398756 /nfs/dbraw/zinc/39/87/56/197398756.db2.gz INMHJHSZIRWTEE-HOCLYGCPSA-N 0 3 305.397 3.458 20 70 DGIDHN C[C@H]1CN(Cc2ccccc2)C[C@@H]1Nc1nnc(C2CC2)s1 ZINC000160225899 197393884 /nfs/dbraw/zinc/39/38/84/197393884.db2.gz HNBVINNDHMJYQY-WFASDCNBSA-N 0 3 314.458 3.348 20 70 DGIDHN Cc1ncc([C@@H](C)NCCN(C)Cc2ccc(F)cc2)c(C)n1 ZINC000160119610 197387436 /nfs/dbraw/zinc/38/74/36/197387436.db2.gz WABGWUQXJDEYPG-CYBMUJFWSA-N 0 3 316.424 3.015 20 70 DGIDHN C[C@@H](CN[C@@H](C)c1cncc(F)c1)N1CCc2sccc2C1 ZINC000159871666 197370267 /nfs/dbraw/zinc/37/02/67/197370267.db2.gz PAQWXWRKKUFIIX-STQMWFEESA-N 0 3 319.449 3.380 20 70 DGIDHN CCN1CCCN(C(=O)N[C@@H](C)C(C)(C)c2ccccc2)CC1 ZINC000159814655 197366441 /nfs/dbraw/zinc/36/64/41/197366441.db2.gz KAXDGDZARCQGNO-INIZCTEOSA-N 0 3 317.477 3.090 20 70 DGIDHN c1coc(-c2nc(CN[C@@H]3[C@@H]4CCO[C@@H]4C34CCC4)cs2)c1 ZINC000159466164 197355839 /nfs/dbraw/zinc/35/58/39/197355839.db2.gz DJBLXAUBFGTDPZ-CFVMTHIKSA-N 0 3 316.426 3.450 20 70 DGIDHN COCCN(C)CCN[C@H]1CCc2c1ccc(Cl)c2Cl ZINC000159427724 284960351 /nfs/dbraw/zinc/96/03/51/284960351.db2.gz SSVVJOHXRPNCFZ-AWEZNQCLSA-N 0 3 317.260 3.149 20 70 DGIDHN CC[C@@H](N[C@@H](C)C(=O)NCc1ccco1)c1ccc(F)cc1 ZINC000160833854 400736806 /nfs/dbraw/zinc/73/68/06/400736806.db2.gz JVCHSYQWBRXOJK-BLLLJJGKSA-N 0 3 304.365 3.164 20 70 DGIDHN C[C@H](CSCc1ccccc1)C(=O)N1CCC[C@@H](N(C)C)C1 ZINC000161481732 228252797 /nfs/dbraw/zinc/25/27/97/228252797.db2.gz PGBPNAXFQFPSSC-NVXWUHKLSA-N 0 3 320.502 3.109 20 70 DGIDHN C[C@H](NCc1ccoc1)[C@@H]1CCCN(C(=O)OC(C)(C)C)C1 ZINC000218175832 432658209 /nfs/dbraw/zinc/65/82/09/432658209.db2.gz GFYVISCCQOWFAM-DZGCQCFKSA-N 0 3 308.422 3.405 20 70 DGIDHN Cc1cccc(N2CCN(C[C@H](O)Cc3ccccc3)CC2)c1C ZINC000218681372 432660025 /nfs/dbraw/zinc/66/00/25/432660025.db2.gz ZPSMZRLAOKDFHA-HXUWFJFHSA-N 0 3 324.468 3.029 20 70 DGIDHN Cc1cccc(CCN[C@H](C(=O)NC2CC2)c2ccccc2)c1 ZINC000159843349 432697354 /nfs/dbraw/zinc/69/73/54/432697354.db2.gz VONDLEWYDVONLQ-IBGZPJMESA-N 0 3 308.425 3.147 20 70 DGIDHN Cc1ccc(CNC(=O)N(CCN(C)C)C2CCCC2)s1 ZINC000159970082 432702584 /nfs/dbraw/zinc/70/25/84/432702584.db2.gz CSXVZFNYFGHKKY-UHFFFAOYSA-N 0 3 309.479 3.072 20 70 DGIDHN CNC(=O)c1ccc(CN2CCC[C@H]2c2cccc(C)n2)cc1 ZINC000160161692 432708608 /nfs/dbraw/zinc/70/86/08/432708608.db2.gz JQCLHKKNJZHXBL-SFHVURJKSA-N 0 3 309.413 3.087 20 70 DGIDHN CSC[C@@H](CCO)N[C@@H](C)c1ccccc1OC(F)F ZINC000160244576 432711531 /nfs/dbraw/zinc/71/15/31/432711531.db2.gz GKUICQGLURUWJI-WDEREUQCSA-N 0 3 305.390 3.053 20 70 DGIDHN CSc1ccc([C@@H](C)N[C@@H]2CCc3nc(C)nn3C2)cc1F ZINC000160405124 432719118 /nfs/dbraw/zinc/71/91/18/432719118.db2.gz UXWSDUUHNKRNSI-ZWNOBZJWSA-N 0 3 320.437 3.113 20 70 DGIDHN CC(C)(C)[C@H](N)C(=O)NCC1(c2cccs2)CCCCC1 ZINC000160496491 432722949 /nfs/dbraw/zinc/72/29/49/432722949.db2.gz BXVIAZQEXLBPTJ-CQSZACIVSA-N 0 3 308.491 3.440 20 70 DGIDHN Cc1nc2n(n1)C[C@@H](N[C@@H](C)c1ccc(OC(C)C)cc1)CC2 ZINC000160491323 432723725 /nfs/dbraw/zinc/72/37/25/432723725.db2.gz GQJXJOTVXKUANO-BBRMVZONSA-N 0 3 314.433 3.039 20 70 DGIDHN Cc1nc2n(n1)C[C@@H](N[C@@H](C)c1cccc(C(F)(F)F)c1)CC2 ZINC000160483680 432723770 /nfs/dbraw/zinc/72/37/70/432723770.db2.gz WTDDDWKAANNNNB-HZMBPMFUSA-N 0 3 324.350 3.271 20 70 DGIDHN COC(=O)COc1cccc(CN[C@@H](C)c2ccccc2C)c1 ZINC000159642444 432689992 /nfs/dbraw/zinc/68/99/92/432689992.db2.gz KQKACTLZVORWDQ-HNNXBMFYSA-N 0 3 313.397 3.398 20 70 DGIDHN CCOc1ccccc1CNC(=O)c1ccc(CN(C)C)cc1 ZINC000160913964 432750187 /nfs/dbraw/zinc/75/01/87/432750187.db2.gz SJSOETRGEFLQJR-UHFFFAOYSA-N 0 3 312.413 3.077 20 70 DGIDHN Cc1ccsc1[C@@H](C)NCc1ccccc1CS(C)(=O)=O ZINC000160940931 432751243 /nfs/dbraw/zinc/75/12/43/432751243.db2.gz QUHZTXMEKWJRHD-CYBMUJFWSA-N 0 3 323.483 3.452 20 70 DGIDHN COc1ccc(CN(C)CCCCn2ccnc2C)c(OC)c1 ZINC000161288340 432771825 /nfs/dbraw/zinc/77/18/25/432771825.db2.gz ODTNFJPPSHUTEE-UHFFFAOYSA-N 0 3 317.433 3.121 20 70 DGIDHN Clc1ccc(CN2CCC[C@@H](c3nnc4n3CCC4)C2)cc1 ZINC000161399446 432775900 /nfs/dbraw/zinc/77/59/00/432775900.db2.gz JZVJQSHDJAIPNZ-CQSZACIVSA-N 0 3 316.836 3.257 20 70 DGIDHN OC[C@H](CN[C@@H]1CCCOc2ccc(F)cc21)c1ccccc1 ZINC000161445002 432779318 /nfs/dbraw/zinc/77/93/18/432779318.db2.gz OJTSJTALZVBJTG-MAUKXSAKSA-N 0 3 315.388 3.405 20 70 DGIDHN C[C@H](NCc1ccc(CN2CCOCC2)cc1)c1cccs1 ZINC000160593833 432729935 /nfs/dbraw/zinc/72/99/35/432729935.db2.gz KPWPIXMIMGVYAT-HNNXBMFYSA-N 0 3 316.470 3.431 20 70 DGIDHN C[C@H](NCCCc1nc2c(s1)CCCC2)c1cnccn1 ZINC000160606055 432730348 /nfs/dbraw/zinc/73/03/48/432730348.db2.gz SSIHFLUPFKSEGD-LBPRGKRZSA-N 0 3 302.447 3.095 20 70 DGIDHN Fc1cc(Cl)ccc1CNCCCOC[C@@H]1CCCO1 ZINC000160668629 432733885 /nfs/dbraw/zinc/73/38/85/432733885.db2.gz YMYXYEXSKIYVNY-AWEZNQCLSA-N 0 3 301.789 3.154 20 70 DGIDHN CCCC[C@@H](COC)N[C@@H](CN1CCCC1=O)c1ccccc1 ZINC000160735318 432738715 /nfs/dbraw/zinc/73/87/15/432738715.db2.gz KDRZYKOOEQVZRR-ROUUACIJSA-N 0 3 318.461 3.145 20 70 DGIDHN CC[C@@H](NCCNC(=O)c1ccccc1F)c1ccc(F)cc1 ZINC000160810375 432742041 /nfs/dbraw/zinc/74/20/41/432742041.db2.gz KEKRNQREPJAQGL-QGZVFWFLSA-N 0 3 318.367 3.436 20 70 DGIDHN c1nc2ccccn2c1CN1CC[C@H](COCc2ccccc2)C1 ZINC000160805630 432743118 /nfs/dbraw/zinc/74/31/18/432743118.db2.gz CDSUIFUWMAPQOU-SFHVURJKSA-N 0 3 321.424 3.373 20 70 DGIDHN Cc1ccsc1CCCC(=O)NCCN1CCCCCC1 ZINC000161285708 534460744 /nfs/dbraw/zinc/46/07/44/534460744.db2.gz MLMMMFLPIZZMED-UHFFFAOYSA-N 0 3 308.491 3.371 20 70 DGIDHN C[C@@H](CN1CCCCC1)NC(=O)[C@H]1C[C@@H]1c1cccc(F)c1F ZINC000160363744 524604784 /nfs/dbraw/zinc/60/47/84/524604784.db2.gz RMXNDJZVROKPAK-CFVMTHIKSA-N 0 3 322.399 3.059 20 70 DGIDHN Cc1nccc(NC(=O)N[C@@H](C)CN2CCCCC2)c1Cl ZINC000159576915 546055104 /nfs/dbraw/zinc/05/51/04/546055104.db2.gz WFQKPTDSSYVJQG-NSHDSACASA-N 0 3 310.829 3.039 20 70 DGIDHN C[C@H](CC(=O)N1CCC[C@H]1CN1CCCCC1)c1ccncc1 ZINC000159909539 546057455 /nfs/dbraw/zinc/05/74/55/546057455.db2.gz BFDPOHZMSRVQBV-AEFFLSMTSA-N 0 3 315.461 3.052 20 70 DGIDHN CCN(C)CCNC(=O)C[C@@H](C)c1cccc(C(F)(F)F)c1 ZINC000160145257 197389011 /nfs/dbraw/zinc/38/90/11/197389011.db2.gz RQUPKHYNVOREAL-GFCCVEGCSA-N 0 3 316.367 3.267 20 70 DGIDHN COc1ccc(CN(C)Cc2cn(C)nc2-c2ccncc2)cc1 ZINC000159868580 197370033 /nfs/dbraw/zinc/37/00/33/197370033.db2.gz PRAWDDJQMOTIFH-UHFFFAOYSA-N 0 3 322.412 3.123 20 70 DGIDHN Cc1ccccc1[C@H](C)NCc1ccccc1CS(C)(=O)=O ZINC000159764780 197362932 /nfs/dbraw/zinc/36/29/32/197362932.db2.gz CFHAEYJHZNCIIA-HNNXBMFYSA-N 0 3 317.454 3.390 20 70 DGIDHN c1coc(-c2nc(CN[C@@H]3[C@H]4CCO[C@@H]4C34CCC4)cs2)c1 ZINC000159466407 197355892 /nfs/dbraw/zinc/35/58/92/197355892.db2.gz DJBLXAUBFGTDPZ-YUELXQCFSA-N 0 3 316.426 3.450 20 70 DGIDHN c1coc(-c2nc(CN[C@H]3[C@@H]4CCO[C@@H]4C34CCC4)cs2)c1 ZINC000159466286 197355857 /nfs/dbraw/zinc/35/58/57/197355857.db2.gz DJBLXAUBFGTDPZ-QEJZJMRPSA-N 0 3 316.426 3.450 20 70 DGIDHN Cc1ccccc1[C@@H](C)NCc1cccc(CS(C)(=O)=O)c1 ZINC000159374181 197348987 /nfs/dbraw/zinc/34/89/87/197348987.db2.gz HDADHGHBKHOERS-OAHLLOKOSA-N 0 3 317.454 3.390 20 70 DGIDHN CCc1ccc([C@H](C)CC(=O)N[C@@H]2CCN(CC3CC3)C2)cc1 ZINC000159495052 400729703 /nfs/dbraw/zinc/72/97/03/400729703.db2.gz CWAUEFQNWPPWPZ-DNVCBOLYSA-N 0 3 314.473 3.343 20 70 DGIDHN CN(CCNCc1cccc2[nH]ccc21)C(=O)OC(C)(C)C ZINC000218182751 432658836 /nfs/dbraw/zinc/65/88/36/432658836.db2.gz UFSNZRFHICMLFQ-UHFFFAOYSA-N 0 3 303.406 3.124 20 70 DGIDHN CCc1ccc([C@@H](CNC(=O)c2[nH]c(C)cc2C)N(C)C)cc1 ZINC000159653985 432692185 /nfs/dbraw/zinc/69/21/85/432692185.db2.gz TVPMUSUGCLTYNA-QGZVFWFLSA-N 0 3 313.445 3.227 20 70 DGIDHN Cc1cccc([C@@H]2CCCN2CCCOCC(F)(F)F)n1 ZINC000159960657 432703659 /nfs/dbraw/zinc/70/36/59/432703659.db2.gz WHKBICBCEUSWRJ-AWEZNQCLSA-N 0 3 302.340 3.496 20 70 DGIDHN CSC[C@@H](CCO)N[C@@H](C)c1ccccc1OC(F)(F)F ZINC000160187222 432710548 /nfs/dbraw/zinc/71/05/48/432710548.db2.gz QUCSLCYEYUALEG-WDEREUQCSA-N 0 3 323.380 3.350 20 70 DGIDHN O=C(NCCN1CCCCCC1)[C@@H]1C[C@@H]1c1cccc(F)c1F ZINC000160220586 432712471 /nfs/dbraw/zinc/71/24/71/432712471.db2.gz KSFXZKFAKALJHD-HUUCEWRRSA-N 0 3 322.399 3.061 20 70 DGIDHN CCN(C(=O)N[C@@H]1C[C@@H](C)N(Cc2ccccc2)C1)C(C)C ZINC000160313330 432713903 /nfs/dbraw/zinc/71/39/03/432713903.db2.gz XRRPMBSXTXDKRN-NVXWUHKLSA-N 0 3 303.450 3.089 20 70 DGIDHN Cc1ccc(C(=O)CCN2CC[C@H](Oc3ccncc3)C2)cc1 ZINC000160329931 432716208 /nfs/dbraw/zinc/71/62/08/432716208.db2.gz UGRAJAQZMAAGKC-SFHVURJKSA-N 0 3 310.397 3.116 20 70 DGIDHN CCCCN(C)C(=O)N[C@@H]1C[C@@H](C)N(Cc2ccccc2)C1 ZINC000160342748 432716423 /nfs/dbraw/zinc/71/64/23/432716423.db2.gz MUHORULTGZTZNP-NVXWUHKLSA-N 0 3 303.450 3.091 20 70 DGIDHN COC[C@H](NCc1ccc(N2CCCCCC2)nc1)C(C)C ZINC000160546765 432726657 /nfs/dbraw/zinc/72/66/57/432726657.db2.gz GHPQOQFWJVPRFO-KRWDZBQOSA-N 0 3 305.466 3.223 20 70 DGIDHN CCOc1c(CN[C@@H]2CCOC(C)(C)C2)c(C)nn1CC(C)C ZINC000160452664 432721251 /nfs/dbraw/zinc/72/12/51/432721251.db2.gz DPWQSSAQWSZTRM-OAHLLOKOSA-N 0 3 323.481 3.293 20 70 DGIDHN CC(C)CN1CCC[C@@H]1CNC(=O)c1cc2ccccc2o1 ZINC000160526913 432724529 /nfs/dbraw/zinc/72/45/29/432724529.db2.gz GHIAOCDGHJCXHT-OAHLLOKOSA-N 0 3 300.402 3.283 20 70 DGIDHN COCCN(C)CCN[C@@H](C)c1cc(Cl)cc(Cl)c1 ZINC000159411948 432684239 /nfs/dbraw/zinc/68/42/39/432684239.db2.gz NZLHDZBOTPWKGJ-NSHDSACASA-N 0 3 305.249 3.222 20 70 DGIDHN CC(C)S(=O)(=O)CCCN1CCC[C@@H]1C1CCCCC1 ZINC000160920554 432750106 /nfs/dbraw/zinc/75/01/06/432750106.db2.gz XSAWFJUIOORKRG-MRXNPFEDSA-N 0 3 301.496 3.244 20 70 DGIDHN CC[C@H](CSc1ccc(Cl)cc1)NCC(=O)NC(C)C ZINC000160992249 432752620 /nfs/dbraw/zinc/75/26/20/432752620.db2.gz ZBPQHSHGXNFZAQ-CYBMUJFWSA-N 0 3 314.882 3.325 20 70 DGIDHN C[C@H](c1cccnc1)N(C)CC1CCN(C(=O)C(C)(C)C)CC1 ZINC000161188909 432764581 /nfs/dbraw/zinc/76/45/81/432764581.db2.gz NYQZTGPTQSLSRP-OAHLLOKOSA-N 0 3 317.477 3.359 20 70 DGIDHN Cc1ccoc1C(=O)NCCCN[C@@H](C)c1ccccc1F ZINC000161212768 432766649 /nfs/dbraw/zinc/76/66/49/432766649.db2.gz SLHCXJWULJHYKE-ZDUSSCGKSA-N 0 3 304.365 3.198 20 70 DGIDHN CCCN(CCO)Cc1cn(C)nc1-c1cc2ccccc2o1 ZINC000161220842 432767275 /nfs/dbraw/zinc/76/72/75/432767275.db2.gz GHGOLXCKHQSLFJ-UHFFFAOYSA-N 0 3 313.401 3.038 20 70 DGIDHN CC(=O)Nc1cccc([C@H](C)NC[C@@H](CO)c2ccccc2)c1 ZINC000161401134 432776973 /nfs/dbraw/zinc/77/69/73/432776973.db2.gz HJFXHBACBGDXEX-KSSFIOAISA-N 0 3 312.413 3.072 20 70 DGIDHN OC[C@@H](CN[C@@H]1CCCOc2ccc(F)cc21)c1ccccc1 ZINC000161445120 432779288 /nfs/dbraw/zinc/77/92/88/432779288.db2.gz OJTSJTALZVBJTG-CRAIPNDOSA-N 0 3 315.388 3.405 20 70 DGIDHN CC1(C)C[C@@H](NCc2csc(-c3ccccn3)n2)CCO1 ZINC000160605054 432730423 /nfs/dbraw/zinc/73/04/23/432730423.db2.gz DUHNFRBMGUTIFB-LBPRGKRZSA-N 0 3 303.431 3.252 20 70 DGIDHN CC1(C)C[C@H](NCc2csc(-c3ccccn3)n2)CCO1 ZINC000160604933 432730766 /nfs/dbraw/zinc/73/07/66/432730766.db2.gz DUHNFRBMGUTIFB-GFCCVEGCSA-N 0 3 303.431 3.252 20 70 DGIDHN CC[C@@H](NCC(C)(C)N1CCOCC1)c1ccc(F)cc1F ZINC000160658602 432734624 /nfs/dbraw/zinc/73/46/24/432734624.db2.gz MTGLROGCBCHBSI-MRXNPFEDSA-N 0 3 312.404 3.116 20 70 DGIDHN CCC[C@H](NC[C@H](O)CN(C)C)c1ccc(Cl)cc1Cl ZINC000159430813 292792485 /nfs/dbraw/zinc/79/24/85/292792485.db2.gz ZIGMKHMSHVVIHZ-WFASDCNBSA-N 0 3 319.276 3.347 20 70 DGIDHN CN1CC[C@H]2[C@H](CCCN2C(=O)CCCSC(C)(C)C)C1 ZINC000160768632 290241638 /nfs/dbraw/zinc/24/16/38/290241638.db2.gz KKVLVVLIFJCUDU-CABCVRRESA-N 0 3 312.523 3.241 20 70 DGIDHN C[C@H](C(=O)NCC(C)(C)N1CCCCC1)c1c(F)cccc1F ZINC000160907635 292823916 /nfs/dbraw/zinc/82/39/16/292823916.db2.gz ICGUWUIOXXAGRD-ZDUSSCGKSA-N 0 3 324.415 3.449 20 70 DGIDHN CC(C)N(CCN(C)C)C(=O)[C@H](C)Cc1ccc(Cl)cc1 ZINC000161184665 292830859 /nfs/dbraw/zinc/83/08/59/292830859.db2.gz KCARDJQHRMXOLU-CQSZACIVSA-N 0 3 310.869 3.317 20 70 DGIDHN COc1ccc(Cl)cc1CN[C@@H]1[C@@H]2CCO[C@@H]2C12CCC2 ZINC000159643587 524210487 /nfs/dbraw/zinc/21/04/87/524210487.db2.gz GSVAAWBFCUHRRA-IMJJTQAJSA-N 0 3 307.821 3.396 20 70 DGIDHN CSC[C@@H](CCO)N[C@H](C)c1cccc(OC(F)(F)F)c1 ZINC000160412004 525643209 /nfs/dbraw/zinc/64/32/09/525643209.db2.gz OASULHXOQSDAPU-ZYHUDNBSSA-N 0 3 323.380 3.350 20 70 DGIDHN Cc1ccc(C(=O)CCN(CCCO)Cc2ccccc2)cc1 ZINC000160300814 526042979 /nfs/dbraw/zinc/04/29/79/526042979.db2.gz LYEBJCBZQLFKJB-UHFFFAOYSA-N 0 3 311.425 3.452 20 70 DGIDHN CCN1CCCN(C(=O)N[C@@H](C)c2cc(C)cc(C)c2)CC1 ZINC000159832269 529029526 /nfs/dbraw/zinc/02/95/26/529029526.db2.gz UNJGEEAOZYGOKE-INIZCTEOSA-N 0 3 303.450 3.102 20 70 DGIDHN CCC(CC)(CC)CNC(=O)N1CCN(c2ccncc2)CC1 ZINC000159926249 546057403 /nfs/dbraw/zinc/05/74/03/546057403.db2.gz LPBIDVLLOCHYBH-UHFFFAOYSA-N 0 3 318.465 3.130 20 70 DGIDHN CCN(C(=O)NCCC1CC1)[C@H]1CCN(Cc2ccccc2)C1 ZINC000160442821 546059996 /nfs/dbraw/zinc/05/99/96/546059996.db2.gz AYYKZZXHAXJGJP-SFHVURJKSA-N 0 3 315.461 3.093 20 70 DGIDHN Cc1ccccc1[C@H](CC(C)C)NCC(=O)NCC(F)(F)F ZINC000160630405 292818607 /nfs/dbraw/zinc/81/86/07/292818607.db2.gz BISKPIBKHJMZMQ-AWEZNQCLSA-N 0 3 316.367 3.350 20 70 DGIDHN CCn1cc([C@@H](C)NC[C@H](C)N2CCc3ccccc3C2)cn1 ZINC000159817020 197366612 /nfs/dbraw/zinc/36/66/12/197366612.db2.gz HOWCXKWHLDJVHN-JKSUJKDBSA-N 0 3 312.461 3.000 20 70 DGIDHN CSC[C@@H](CCO)N[C@@H]1CCCOc2c(Cl)cccc21 ZINC000160205615 295611937 /nfs/dbraw/zinc/61/19/37/295611937.db2.gz KOPOPGXNOXMFMR-BXUZGUMPSA-N 0 3 315.866 3.257 20 70 DGIDHN Cc1cccc(C(C)(C)NC(=O)N[C@@H]2CCN(CC3CC3)C2)c1 ZINC000160662623 400735051 /nfs/dbraw/zinc/73/50/51/400735051.db2.gz HFEMPSZSERVXSS-QGZVFWFLSA-N 0 3 315.461 3.014 20 70 DGIDHN COc1ccccc1CCN(C)Cc1c(C)nc2ccccn21 ZINC000159831658 278048503 /nfs/dbraw/zinc/04/85/03/278048503.db2.gz HPEKOJKRSLFDSD-UHFFFAOYSA-N 0 3 309.413 3.326 20 70 DGIDHN C[C@H](CN[C@@H](C)c1cncs1)N1CCc2sccc2C1 ZINC000159856175 279348488 /nfs/dbraw/zinc/34/84/88/279348488.db2.gz IUWVQNPYLJZYHO-NEPJUHHUSA-N 0 3 307.488 3.302 20 70 DGIDHN Cc1c(CN[C@H]2CCc3cc(Br)ccc32)cnn1C ZINC000161218235 280227860 /nfs/dbraw/zinc/22/78/60/280227860.db2.gz CABVHAVBGPOKIO-HNNXBMFYSA-N 0 3 320.234 3.268 20 70 DGIDHN CC[C@@H](C)c1cc(C(=O)NCc2cccc(CN(C)C)c2)on1 ZINC000159719066 432694273 /nfs/dbraw/zinc/69/42/73/432694273.db2.gz IMFADCWXZMQSGA-CYBMUJFWSA-N 0 3 315.417 3.180 20 70 DGIDHN Cc1cc2cc(CN3CCC(CC(N)=O)CC3)oc2cc1C ZINC000159801152 432697785 /nfs/dbraw/zinc/69/77/85/432697785.db2.gz KONRMBFCQMAPNO-UHFFFAOYSA-N 0 3 300.402 3.137 20 70 DGIDHN Cc1cccc([C@H]2CCCN2CCCOCC(F)(F)F)n1 ZINC000159960783 432702944 /nfs/dbraw/zinc/70/29/44/432702944.db2.gz WHKBICBCEUSWRJ-CQSZACIVSA-N 0 3 302.340 3.496 20 70 DGIDHN CCCC(=O)N[C@@H]1CCCN(CCCc2cccc(OC)c2)C1 ZINC000160187911 432709614 /nfs/dbraw/zinc/70/96/14/432709614.db2.gz OZTFXORXKWLSRN-QGZVFWFLSA-N 0 3 318.461 3.009 20 70 DGIDHN CSC[C@@H](CCO)N[C@H](C)c1ccccc1OC(F)(F)F ZINC000160187355 432710436 /nfs/dbraw/zinc/71/04/36/432710436.db2.gz QUCSLCYEYUALEG-GHMZBOCLSA-N 0 3 323.380 3.350 20 70 DGIDHN O=C(NCCN1CCCCCC1)[C@H]1C[C@@H]1c1cccc(F)c1F ZINC000160220338 432712391 /nfs/dbraw/zinc/71/23/91/432712391.db2.gz KSFXZKFAKALJHD-CABCVRRESA-N 0 3 322.399 3.061 20 70 DGIDHN CCCO[C@@H]1CCCN(Cc2c(C)nc3ccccn32)CC1 ZINC000160276439 432714457 /nfs/dbraw/zinc/71/44/57/432714457.db2.gz LNGSONAGRYZBRP-MRXNPFEDSA-N 0 3 301.434 3.424 20 70 DGIDHN CC(C)(C)c1nsc(N2CCCC[C@H](N3CCCC3)C2)n1 ZINC000159389506 432681511 /nfs/dbraw/zinc/68/15/11/432681511.db2.gz CFYVBAZOZWWNEI-ZDUSSCGKSA-N 0 3 308.495 3.290 20 70 DGIDHN CN(Cc1ccc(F)c(Br)c1)C[C@@H]1CCC[C@@H]1O ZINC000159483504 432685787 /nfs/dbraw/zinc/68/57/87/432685787.db2.gz ZYZMIPKHSRWBAF-FZMZJTMJSA-N 0 3 316.214 3.181 20 70 DGIDHN C[C@@H](C(=O)N1CCC(OC(C)(C)C)CC1)N1[C@H](C)CC[C@@H]1C ZINC000160967940 432751560 /nfs/dbraw/zinc/75/15/60/432751560.db2.gz XFPUSKIPJLRRGN-ZNMIVQPWSA-N 0 3 310.482 3.054 20 70 DGIDHN CCCN(CCO)Cc1c(C)nn(-c2ccc(Cl)cc2)c1C ZINC000161201063 432765118 /nfs/dbraw/zinc/76/51/18/432765118.db2.gz RTCSEKCSRYEDNB-UHFFFAOYSA-N 0 3 321.852 3.347 20 70 DGIDHN COc1ccc(OC)c([C@@H](C)NC[C@@H](CO)c2ccccc2)c1 ZINC000161425874 432777382 /nfs/dbraw/zinc/77/73/82/432777382.db2.gz OKISFLGWYORYNR-ZBFHGGJFSA-N 0 3 315.413 3.131 20 70 DGIDHN OC[C@H](CN[C@H]1CCCOc2ccc(F)cc21)c1ccccc1 ZINC000161445241 432780142 /nfs/dbraw/zinc/78/01/42/432780142.db2.gz OJTSJTALZVBJTG-YJBOKZPZSA-N 0 3 315.388 3.405 20 70 DGIDHN CCCC[C@H](NCC(=O)NCC(F)(F)F)c1ccc(F)cc1 ZINC000160587558 432730665 /nfs/dbraw/zinc/73/06/65/432730665.db2.gz HBOCOKPHNLEIPU-ZDUSSCGKSA-N 0 3 320.330 3.325 20 70 DGIDHN Fc1cc(Cl)ccc1CNC[C@@H]1CCN(CC(F)(F)F)C1 ZINC000160766862 432741035 /nfs/dbraw/zinc/74/10/35/432741035.db2.gz PGWSGBMZWMNRTQ-JTQLQIEISA-N 0 3 324.749 3.453 20 70 DGIDHN C[C@@H](CC(=O)N1CCCNCC1)c1cccc(C(F)(F)F)c1 ZINC000160823928 432743791 /nfs/dbraw/zinc/74/37/91/432743791.db2.gz FGBZTGGXZSTKJG-LBPRGKRZSA-N 0 3 314.351 3.021 20 70 DGIDHN C[C@H](C(=O)N[C@@H]1CCOC2(CCCCC2)C1)N1CCCCCC1 ZINC000160729546 289364757 /nfs/dbraw/zinc/36/47/57/289364757.db2.gz DXEFOPLWCYSZBN-IAGOWNOFSA-N 0 3 322.493 3.249 20 70 DGIDHN Cc1ccsc1[C@H]1C[C@H]1C(=O)NCCN1CCCCCC1 ZINC000161286329 292830646 /nfs/dbraw/zinc/83/06/46/292830646.db2.gz CVRNYXMJUSWAGY-LSDHHAIUSA-N 0 3 306.475 3.152 20 70 DGIDHN Cc1ccsc1CCCC(=O)N[C@H](C)CN1CCCCC1 ZINC000161431217 534464546 /nfs/dbraw/zinc/46/45/46/534464546.db2.gz YBHRDGKHLWRPJB-OAHLLOKOSA-N 0 3 308.491 3.370 20 70 DGIDHN CSC[C@H](CCO)N[C@@H](C)c1ccc(F)cc1OC(F)F ZINC000160390874 525699775 /nfs/dbraw/zinc/69/97/75/525699775.db2.gz SJQBBAIBVPUOSJ-ONGXEEELSA-N 0 3 323.380 3.192 20 70 DGIDHN Cc1nc2n(n1)C[C@@H](N[C@H](C)c1ccc3c(c1)CCCC3)CC2 ZINC000160527917 282118518 /nfs/dbraw/zinc/11/85/18/282118518.db2.gz LCCQHSABNIFMNA-ACJLOTCBSA-N 0 3 310.445 3.131 20 70 DGIDHN C[C@H](NC[C@](C)(O)c1ccsc1)c1ccc2c(c1)OCO2 ZINC000160114561 197387236 /nfs/dbraw/zinc/38/72/36/197387236.db2.gz FFPZPYKAQUQVBE-ZBEGNZNMSA-N 0 3 305.399 3.035 20 70 DGIDHN C[C@H](CN[C@H](C)c1cncs1)N1CCc2sccc2C1 ZINC000159856449 197368776 /nfs/dbraw/zinc/36/87/76/197368776.db2.gz IUWVQNPYLJZYHO-VXGBXAGGSA-N 0 3 307.488 3.302 20 70 DGIDHN Cc1ncc([C@@H](C)NC[C@@H](C)N2CCc3ccccc3C2)c(C)n1 ZINC000159805115 197365499 /nfs/dbraw/zinc/36/54/99/197365499.db2.gz QYDYHAIRVUPTJB-HUUCEWRRSA-N 0 3 324.472 3.191 20 70 DGIDHN COCCCOC1CCN(CCC(=O)c2ccc(C)cc2)CC1 ZINC000159803569 197365179 /nfs/dbraw/zinc/36/51/79/197365179.db2.gz QCCIKKOSANRWLN-UHFFFAOYSA-N 0 3 319.445 3.085 20 70 DGIDHN Cc1ccc(N[C@@H](C)CCn2cccn2)c(OCCN(C)C)c1 ZINC000159462108 197355081 /nfs/dbraw/zinc/35/50/81/197355081.db2.gz UDZLGQDJMVTAAD-INIZCTEOSA-N 0 3 316.449 3.023 20 70 DGIDHN CC[C@@H](NC[C@@H]1CN(CC(C)C)CCO1)c1ccc(C)cc1 ZINC000216641955 165375379 /nfs/dbraw/zinc/37/53/79/165375379.db2.gz BMVKDADCRIFLKB-RTBURBONSA-N 0 3 304.478 3.393 20 70 DGIDHN C[C@@H](CNC(=O)NCC(C)(C)Cc1ccccc1)N(C)C1CC1 ZINC000217229867 165377689 /nfs/dbraw/zinc/37/76/89/165377689.db2.gz DATYBULWZAFODC-HNNXBMFYSA-N 0 3 317.477 3.037 20 70 DGIDHN Cc1ccsc1[C@H]1C[C@@H]1C(=O)NCCN1CCCCCC1 ZINC000161286082 228251634 /nfs/dbraw/zinc/25/16/34/228251634.db2.gz CVRNYXMJUSWAGY-GJZGRUSLSA-N 0 3 306.475 3.152 20 70 DGIDHN C[C@H](CSCc1ccccc1)C(=O)N1CCC[C@H](N(C)C)C1 ZINC000161481461 228252523 /nfs/dbraw/zinc/25/25/23/228252523.db2.gz PGBPNAXFQFPSSC-WBVHZDCISA-N 0 3 320.502 3.109 20 70 DGIDHN COCCN(C)CCN[C@@H]1CCc2c1ccc(Cl)c2Cl ZINC000159427583 277505618 /nfs/dbraw/zinc/50/56/18/277505618.db2.gz SSVVJOHXRPNCFZ-CQSZACIVSA-N 0 3 317.260 3.149 20 70 DGIDHN Cc1c(CN[C@@H]2CCc3cc(Br)ccc32)cnn1C ZINC000161218097 280227403 /nfs/dbraw/zinc/22/74/03/280227403.db2.gz CABVHAVBGPOKIO-OAHLLOKOSA-N 0 3 320.234 3.268 20 70 DGIDHN Brc1ccccc1CN[C@@H]1[C@H]2CCO[C@@H]2C12CCC2 ZINC000159658487 432692755 /nfs/dbraw/zinc/69/27/55/432692755.db2.gz ANUSOBZIWFOLAA-YUELXQCFSA-N 0 3 322.246 3.496 20 70 DGIDHN CC(C)c1ncc(C(=O)N[C@H](C)CN2CCC[C@@H](C)C2)s1 ZINC000159785112 432695465 /nfs/dbraw/zinc/69/54/65/432695465.db2.gz OUHAJAAXZFQMPY-CHWSQXEVSA-N 0 3 309.479 3.117 20 70 DGIDHN CCCN(C(=O)N[C@@H]1CN(Cc2ccccc2)C[C@@H]1C)C1CC1 ZINC000159959619 432702307 /nfs/dbraw/zinc/70/23/07/432702307.db2.gz AFNNUTQBOQEDIA-MAUKXSAKSA-N 0 3 315.461 3.091 20 70 DGIDHN CSC[C@H](CCO)N[C@H](C)c1cc(C)ccc1OC(F)F ZINC000160213974 432711977 /nfs/dbraw/zinc/71/19/77/432711977.db2.gz ZQDODXBOOKVBIM-NEPJUHHUSA-N 0 3 319.417 3.361 20 70 DGIDHN c1ccc2c(c1)CC[C@H]2NCc1ccccc1CN1CCOCC1 ZINC000160440656 432722041 /nfs/dbraw/zinc/72/20/41/432722041.db2.gz MIYKOBDNLKDRMY-OAQYLSRUSA-N 0 3 322.452 3.296 20 70 DGIDHN CC(C)CN1CCC[C@@H]1CNC(=O)c1cnc(C(C)C)s1 ZINC000160515564 432724843 /nfs/dbraw/zinc/72/48/43/432724843.db2.gz WDWLEQRDFVANHF-CYBMUJFWSA-N 0 3 309.479 3.117 20 70 DGIDHN CC(C)[C@@H](CNC(=O)[C@H](C)N)Cc1ccc(Cl)cc1Cl ZINC000159532672 432686445 /nfs/dbraw/zinc/68/64/45/432686445.db2.gz DHEXJXLWDXELNT-CMPLNLGQSA-N 0 3 317.260 3.272 20 70 DGIDHN C[C@H](CN[C@@H](C)c1cncc(F)c1)N(C)Cc1ccccc1 ZINC000160881774 432747111 /nfs/dbraw/zinc/74/71/11/432747111.db2.gz VTJKOIFPDVZBBQ-CABCVRRESA-N 0 3 301.409 3.392 20 70 DGIDHN CC(C)[C@H](N)C(=O)N(CCc1ccc(Cl)cc1)CC1CC1 ZINC000160882146 432748289 /nfs/dbraw/zinc/74/82/89/432748289.db2.gz TZNQKSZQFGDLFT-INIZCTEOSA-N 0 3 308.853 3.104 20 70 DGIDHN Cc1ccc([C@@H](C)CN[C@H](C(N)=O)c2ccc(F)cc2)cc1 ZINC000161049690 432756137 /nfs/dbraw/zinc/75/61/37/432756137.db2.gz WYPKAUMNHSJAFI-GUYCJALGSA-N 0 3 300.377 3.054 20 70 DGIDHN CCOCCC1(CNC(=O)c2ccc(CN(C)C)cc2)CCC1 ZINC000161072807 432758136 /nfs/dbraw/zinc/75/81/36/432758136.db2.gz UYWRQTHIUDYKQD-UHFFFAOYSA-N 0 3 318.461 3.075 20 70 DGIDHN CC[C@@H](C(=O)N1CCC[C@H]2CN(C)CC[C@@H]21)c1ccc(F)cc1 ZINC000161264393 432769736 /nfs/dbraw/zinc/76/97/36/432769736.db2.gz GJCNVSYMMXTNIV-JQHSSLGASA-N 0 3 318.436 3.262 20 70 DGIDHN Cc1ccccc1OCCN[C@H](C)c1ccc([S@@](C)=O)cc1 ZINC000161351656 432774159 /nfs/dbraw/zinc/77/41/59/432774159.db2.gz LLQHPPURTSXDCL-QRQCRPRQSA-N 0 3 317.454 3.462 20 70 DGIDHN Clc1ccc(CN2CCC[C@H](c3nnc4n3CCC4)C2)cc1 ZINC000161399306 432775980 /nfs/dbraw/zinc/77/59/80/432775980.db2.gz JZVJQSHDJAIPNZ-AWEZNQCLSA-N 0 3 316.836 3.257 20 70 DGIDHN Clc1ccccc1CN1CCC[C@H](c2nnc3n2CCC3)C1 ZINC000161407833 432777540 /nfs/dbraw/zinc/77/75/40/432777540.db2.gz HVPPPHBVXSVYIS-AWEZNQCLSA-N 0 3 316.836 3.257 20 70 DGIDHN COc1ccc(OC)c([C@H](C)NC[C@H](CO)c2ccccc2)c1 ZINC000161426007 432778188 /nfs/dbraw/zinc/77/81/88/432778188.db2.gz OKISFLGWYORYNR-GOEBONIOSA-N 0 3 315.413 3.131 20 70 DGIDHN CC[C@H](NCCCN1CCOCC1)c1cccc(Cl)c1F ZINC000161474842 432781440 /nfs/dbraw/zinc/78/14/40/432781440.db2.gz ADHXVCUHDOCOFE-HNNXBMFYSA-N 0 3 314.832 3.242 20 70 DGIDHN CC[C@H](C(=O)NCCCOc1ccc2ccccc2c1)N(C)C ZINC000160569501 432728074 /nfs/dbraw/zinc/72/80/74/432728074.db2.gz BALCUESDGFDFKH-GOSISDBHSA-N 0 3 314.429 3.065 20 70 DGIDHN CC[C@@H](C(=O)NCCCOc1ccc2ccccc2c1)N(C)C ZINC000160569358 432728314 /nfs/dbraw/zinc/72/83/14/432728314.db2.gz BALCUESDGFDFKH-SFHVURJKSA-N 0 3 314.429 3.065 20 70 DGIDHN CCc1nc(CN[C@H](COc2ccccc2F)C(C)(C)C)n[nH]1 ZINC000160561211 432728355 /nfs/dbraw/zinc/72/83/55/432728355.db2.gz DCYFAIRROWTQOD-CQSZACIVSA-N 0 3 320.412 3.090 20 70 DGIDHN COc1ccc(OC(F)F)c(CN[C@H]2CCOC(C)(C)C2)c1 ZINC000160586210 432730227 /nfs/dbraw/zinc/73/02/27/432730227.db2.gz LWJCICXGXYTDSU-LBPRGKRZSA-N 0 3 315.360 3.344 20 70 DGIDHN CCCNC(=O)c1cccc(CN[C@@H]2CC(C)(C)OC2(C)C)c1 ZINC000160631042 432732760 /nfs/dbraw/zinc/73/27/60/432732760.db2.gz IEVQMEURGLMFCT-MRXNPFEDSA-N 0 3 318.461 3.262 20 70 DGIDHN CCCC[C@@H](COC)N[C@H](CN1CCCC1=O)c1ccccc1 ZINC000160735566 432739524 /nfs/dbraw/zinc/73/95/24/432739524.db2.gz KDRZYKOOEQVZRR-ZWKOTPCHSA-N 0 3 318.461 3.145 20 70 DGIDHN COc1cc2c(c(CN[C@H]3CCOC(C)(C)C3)c1)O[C@H](C)C2 ZINC000160439108 292815118 /nfs/dbraw/zinc/81/51/18/292815118.db2.gz HVGFWUYDCDTKRP-DOMZBBRYSA-N 0 3 305.418 3.066 20 70 DGIDHN CC(C)CSCCCNC(=O)c1cccc(CN(C)C)c1 ZINC000160834297 292823120 /nfs/dbraw/zinc/82/31/20/292823120.db2.gz DQPCJJHSFCSJNH-UHFFFAOYSA-N 0 3 308.491 3.257 20 70 DGIDHN CC[C@H](NCC(=O)N1CCc2ccccc21)c1ccc(F)cc1 ZINC000160866404 292823530 /nfs/dbraw/zinc/82/35/30/292823530.db2.gz CXCNAXLIBVTEEV-KRWDZBQOSA-N 0 3 312.388 3.456 20 70 DGIDHN CCO[C@@H]1C[C@@H](N[C@@H]2CCCc3c2cnn3C)C1(CC)CC ZINC000161317394 292833338 /nfs/dbraw/zinc/83/33/38/292833338.db2.gz XBAQYZMETAFPJE-DJIMGWMZSA-N 0 3 305.466 3.371 20 70 DGIDHN COC[C@@H](NCc1ccc(N2CCC(C)CC2)nc1)C(C)C ZINC000160502198 522365305 /nfs/dbraw/zinc/36/53/05/522365305.db2.gz CNXTYBODAUVEAY-QGZVFWFLSA-N 0 3 305.466 3.079 20 70 DGIDHN CSC[C@H](CCO)N[C@@H](C)c1ccc(OC(F)(F)F)cc1 ZINC000160413208 525699624 /nfs/dbraw/zinc/69/96/24/525699624.db2.gz OQKMTGOZXDBXNJ-JQWIXIFHSA-N 0 3 323.380 3.350 20 70 DGIDHN Cc1nc2ccccn2c1CN(CCO)[C@H]1CCc2ccccc21 ZINC000160379583 527175087 /nfs/dbraw/zinc/17/50/87/527175087.db2.gz UYLHPMZUPJLJLY-SFHVURJKSA-N 0 3 321.424 3.125 20 70 DGIDHN CCN1CC[C@H]2CC[C@@H](C1)N2C(=O)Nc1ccnc(C)c1Cl ZINC000159653747 546055231 /nfs/dbraw/zinc/05/52/31/546055231.db2.gz PSDDSMXIRWNSFR-OLZOCXBDSA-N 0 3 322.840 3.134 20 70 DGIDHN CCOc1ccccc1NC(=O)CN1CC[C@@H]2CCCC[C@@H]21 ZINC000159678518 546055288 /nfs/dbraw/zinc/05/52/88/546055288.db2.gz NKYMMVSAFJEDPW-HOCLYGCPSA-N 0 3 302.418 3.288 20 70 DGIDHN Fc1ccc(CN2CCN(c3ccncc3)CC2)c(Cl)c1 ZINC000161322617 546067917 /nfs/dbraw/zinc/06/79/17/546067917.db2.gz JQCYIOCCLNKNNK-UHFFFAOYSA-N 0 3 305.784 3.196 20 70 DGIDHN CN1CC[C@@H]2CN(C(=O)Nc3cccc(Cl)c3Cl)C[C@@H]21 ZINC000216669011 546263050 /nfs/dbraw/zinc/26/30/50/546263050.db2.gz VEVQZFSHHOHMPV-SKDRFNHKSA-N 0 3 314.216 3.161 20 70 DGIDHN Cc1nc2n(n1)C[C@H](N[C@@H](C)c1cc(C)c(F)c(C)c1)CC2 ZINC000160569505 282125612 /nfs/dbraw/zinc/12/56/12/282125612.db2.gz ONMQXWIIYUHQSE-SWLSCSKDSA-N 0 3 302.397 3.008 20 70 DGIDHN CSCCCCC(=O)N[C@H]1CCCN(Cc2ccccc2)C1 ZINC000159706546 186136752 /nfs/dbraw/zinc/13/67/52/186136752.db2.gz HJLDNMQSAVHULQ-KRWDZBQOSA-N 0 3 320.502 3.301 20 70 DGIDHN COc1ccc([C@H](NCCc2cnn(C)c2)c2ccccc2)cc1 ZINC000159756563 186139847 /nfs/dbraw/zinc/13/98/47/186139847.db2.gz KSCKCMWDKWMKEP-HXUWFJFHSA-N 0 3 321.424 3.350 20 70 DGIDHN C[C@H](NC[C@H](O)c1ccc(Cl)cc1Cl)c1cnn(C)c1 ZINC000161436477 197494213 /nfs/dbraw/zinc/49/42/13/197494213.db2.gz WQHLWTKBNUBTHC-XPTSAGLGSA-N 0 3 314.216 3.111 20 70 DGIDHN CSCC[C@H](N)C(=O)N[C@H](C)c1cccc(Cl)c1Cl ZINC000160986103 197454916 /nfs/dbraw/zinc/45/49/16/197454916.db2.gz FOQNPOVOGZQWEU-KCJUWKMLSA-N 0 3 321.273 3.251 20 70 DGIDHN CCN(C(=O)N[C@@H]1C[C@H](C)N(Cc2ccccc2)C1)C(C)C ZINC000160313089 197399737 /nfs/dbraw/zinc/39/97/37/197399737.db2.gz XRRPMBSXTXDKRN-DOTOQJQBSA-N 0 3 303.450 3.089 20 70 DGIDHN CCN1CCCN(C(=O)N[C@H](C)C(C)(C)c2ccccc2)CC1 ZINC000159814801 197366525 /nfs/dbraw/zinc/36/65/25/197366525.db2.gz KAXDGDZARCQGNO-MRXNPFEDSA-N 0 3 317.477 3.090 20 70 DGIDHN CC[C@@H](CC(=O)N[C@H]1CCN(CC2CC2)C1)c1ccc(C)cc1 ZINC000159490522 400729837 /nfs/dbraw/zinc/72/98/37/400729837.db2.gz YGJYLGOMRZKIPQ-HKUYNNGSSA-N 0 3 314.473 3.479 20 70 DGIDHN CCS[C@@H]1CCC[C@@H](NC(=O)N(CCN(C)C)C(C)C)C1 ZINC000159421699 286710894 /nfs/dbraw/zinc/71/08/94/286710894.db2.gz GKFFAVNHWIRYDL-HUUCEWRRSA-N 0 3 315.527 3.032 20 70 DGIDHN CCCN(CC(=O)NC(=O)Nc1ccc(C)c(C)c1)CC1CC1 ZINC000217200443 263836216 /nfs/dbraw/zinc/83/62/16/263836216.db2.gz OTTGSFWIXCNBLB-UHFFFAOYSA-N 0 3 317.433 3.074 20 70 DGIDHN O=C(CN1CC[C@@H]2CCCC[C@@H]21)NCc1ccc(Cl)s1 ZINC000159728313 432694588 /nfs/dbraw/zinc/69/45/88/432694588.db2.gz ZYYIXFZPMHUKBV-AAEUAGOBSA-N 0 3 312.866 3.282 20 70 DGIDHN Cc1cccc([C@H](C)C(=O)NC[C@@H](C)N2CCC[C@H](C)C2)c1 ZINC000159874141 432698905 /nfs/dbraw/zinc/69/89/05/432698905.db2.gz WZYNCJKXRPUQCM-BBWFWOEESA-N 0 3 302.462 3.335 20 70 DGIDHN Cc1cccc([C@@H]2CCCN2C[C@H](O)c2ccccc2F)n1 ZINC000159868033 432699169 /nfs/dbraw/zinc/69/91/69/432699169.db2.gz HTVZDXRLJKFLQU-ROUUACIJSA-N 0 3 300.377 3.400 20 70 DGIDHN Cc1cccc([C@H]2CCCN2C[C@H](O)c2ccc(F)cc2)n1 ZINC000159987075 432703812 /nfs/dbraw/zinc/70/38/12/432703812.db2.gz HZWFBHHQNJCUFQ-MSOLQXFVSA-N 0 3 300.377 3.400 20 70 DGIDHN CSC[C@H](CCO)N[C@@H](C)c1cccc(OC(F)F)c1 ZINC000160249240 432712439 /nfs/dbraw/zinc/71/24/39/432712439.db2.gz FVRCYCPUULOCQO-JQWIXIFHSA-N 0 3 305.390 3.053 20 70 DGIDHN CC[C@@H](C)c1cc(C(=O)NC[C@H]2CCCN2CC(C)C)on1 ZINC000160403481 432719075 /nfs/dbraw/zinc/71/90/75/432719075.db2.gz RVGRAWCDTAFIJW-ZIAGYGMSSA-N 0 3 307.438 3.038 20 70 DGIDHN COc1cc2c(c(CN[C@@H]3CCOC(C)(C)C3)c1)O[C@@H](C)C2 ZINC000160438973 432720723 /nfs/dbraw/zinc/72/07/23/432720723.db2.gz HVGFWUYDCDTKRP-SWLSCSKDSA-N 0 3 305.418 3.066 20 70 DGIDHN CC[C@H](C)CN(CC)[C@@H](C)C(=O)Nc1cccc(NC(C)=O)c1 ZINC000160529494 432726729 /nfs/dbraw/zinc/72/67/29/432726729.db2.gz OSLRNKFYMRWVRJ-KBPBESRZSA-N 0 3 319.449 3.340 20 70 DGIDHN COCCN(C)CCN[C@H](C)c1cc(Cl)cc(Cl)c1 ZINC000159412054 432683751 /nfs/dbraw/zinc/68/37/51/432683751.db2.gz NZLHDZBOTPWKGJ-LLVKDONJSA-N 0 3 305.249 3.222 20 70 DGIDHN COc1ccc(COCCCN[C@@H](C)c2cncc(F)c2)cc1 ZINC000161093358 432759120 /nfs/dbraw/zinc/75/91/20/432759120.db2.gz NJZYPEUEEZDLPC-AWEZNQCLSA-N 0 3 318.392 3.487 20 70 DGIDHN Cc1ccccc1OCCN[C@@H](C)c1ccc([S@](C)=O)cc1 ZINC000161351270 432774805 /nfs/dbraw/zinc/77/48/05/432774805.db2.gz LLQHPPURTSXDCL-OYHNWAKOSA-N 0 3 317.454 3.462 20 70 DGIDHN O=C(NC[C@@H](c1ccccc1)N1CCCC1)N[C@@H]1C=CCCC1 ZINC000161395090 432776385 /nfs/dbraw/zinc/77/63/85/432776385.db2.gz XEVPCIJGPOKZHV-MSOLQXFVSA-N 0 3 313.445 3.231 20 70 DGIDHN c1nc2ccccn2c1CN(CCc1ccccc1)[C@@H]1CCOC1 ZINC000161438780 432779244 /nfs/dbraw/zinc/77/92/44/432779244.db2.gz PDJXGUOTKUPSOI-GOSISDBHSA-N 0 3 321.424 3.168 20 70 DGIDHN C[C@H](NC[C@@H](O)c1ccc(Cl)cc1Cl)c1cnn(C)c1 ZINC000161436694 432779670 /nfs/dbraw/zinc/77/96/70/432779670.db2.gz WQHLWTKBNUBTHC-LKFCYVNXSA-N 0 3 314.216 3.111 20 70 DGIDHN C[C@@H](NCc1ccc(CN2CCOCC2)cc1)c1cccs1 ZINC000160593958 432730396 /nfs/dbraw/zinc/73/03/96/432730396.db2.gz KPWPIXMIMGVYAT-OAHLLOKOSA-N 0 3 316.470 3.431 20 70 DGIDHN CC[C@H](NC1CCC(NC(C)=O)CC1)c1ccc(F)cc1F ZINC000160865090 432745284 /nfs/dbraw/zinc/74/52/84/432745284.db2.gz LCWVJMWKJSGMFM-KVULBXGLSA-N 0 3 310.388 3.453 20 70 DGIDHN CC[C@]1(C)C[C@H]1C(=O)NC1CCN(Cc2ccccc2)CC1 ZINC000160843250 432745323 /nfs/dbraw/zinc/74/53/23/432745323.db2.gz PMWJSKHOIQWWCH-PKOBYXMFSA-N 0 3 300.446 3.203 20 70 DGIDHN Cc1ncc([C@@H](C)NC[C@H](C)N(C)Cc2ccccc2)c(C)n1 ZINC000160862686 432745996 /nfs/dbraw/zinc/74/59/96/432745996.db2.gz XTBUQTUNRUVXAK-LSDHHAIUSA-N 0 3 312.461 3.265 20 70 DGIDHN C[C@@H]1C[C@@H](NC(=O)NCc2ccccc2)CN1Cc1ccccc1 ZINC000161502835 432783173 /nfs/dbraw/zinc/78/31/73/432783173.db2.gz XGBBYQAEBRXFHP-VQIMIIECSA-N 0 3 323.440 3.149 20 70 DGIDHN CCC[C@@H](NC[C@@H](O)CN(C)C)c1ccc(Cl)cc1Cl ZINC000159431161 292792532 /nfs/dbraw/zinc/79/25/32/292792532.db2.gz ZIGMKHMSHVVIHZ-IUODEOHRSA-N 0 3 319.276 3.347 20 70 DGIDHN CN1CCC(Oc2ccc(NCc3ccccc3F)cn2)CC1 ZINC000160183495 292809524 /nfs/dbraw/zinc/80/95/24/292809524.db2.gz LWJGZHRMYFQZAD-UHFFFAOYSA-N 0 3 315.392 3.306 20 70 DGIDHN CSC[C@@H](CCO)N[C@H](C)c1ccc(OC(F)(F)F)cc1 ZINC000160413584 525642766 /nfs/dbraw/zinc/64/27/66/525642766.db2.gz OQKMTGOZXDBXNJ-ZYHUDNBSSA-N 0 3 323.380 3.350 20 70 DGIDHN CSC[C@H](CCO)N[C@H](C)c1ccc(OC(F)(F)F)cc1 ZINC000160413324 525699579 /nfs/dbraw/zinc/69/95/79/525699579.db2.gz OQKMTGOZXDBXNJ-PWSUYJOCSA-N 0 3 323.380 3.350 20 70 DGIDHN CSC[C@H](CCO)N[C@H](C)c1cccc(OC(F)F)c1 ZINC000160249382 525702202 /nfs/dbraw/zinc/70/22/02/525702202.db2.gz FVRCYCPUULOCQO-PWSUYJOCSA-N 0 3 305.390 3.053 20 70 DGIDHN CCC[C@H](Cc1ccccc1)NC(=O)N1CCCN(CC)CC1 ZINC000159814143 528157944 /nfs/dbraw/zinc/15/79/44/528157944.db2.gz PZACYOPJZSQUTD-GOSISDBHSA-N 0 3 317.477 3.135 20 70 DGIDHN CCC[C@@H](N[C@@H]1CCN(C(=O)C2CCCC2)C1)c1ccccn1 ZINC000159385975 546053629 /nfs/dbraw/zinc/05/36/29/546053629.db2.gz IDABNKMTUQIEGW-SJLPKXTDSA-N 0 3 315.461 3.304 20 70 DGIDHN CCOc1cc2c(cc1CN[C@@H]1CCOC(C)(C)C1)O[C@H](C)C2 ZINC000160535137 546060870 /nfs/dbraw/zinc/06/08/70/546060870.db2.gz LYUJXKYJZQEUGQ-CZUORRHYSA-N 0 3 319.445 3.456 20 70 DGIDHN CC(C)CN1CCO[C@H](CN[C@@H](C)c2ccccc2Cl)C1 ZINC000216641313 575273511 /nfs/dbraw/zinc/27/35/11/575273511.db2.gz MMMJWLJSGUNUQO-LSDHHAIUSA-N 0 3 310.869 3.347 20 70 DGIDHN CCc1ccccc1C(=O)NC[C@H](Cc1ccccc1)N(C)C ZINC000160713493 529568588 /nfs/dbraw/zinc/56/85/88/529568588.db2.gz ZVWDCQQYJLLIER-SFHVURJKSA-N 0 3 310.441 3.152 20 70 DGIDHN N[C@@H](Cc1ccccc1)C(=O)N[C@H]1CCC[C@H]1c1ccccc1 ZINC000159716417 186137226 /nfs/dbraw/zinc/13/72/26/186137226.db2.gz MKZDECCDSRMEJD-FHWLQOOXSA-N 0 3 308.425 3.009 20 70 DGIDHN COc1ccc([C@H](C)NC[C@H](CO)c2ccccc2)c(F)c1 ZINC000161426978 197494610 /nfs/dbraw/zinc/49/46/10/197494610.db2.gz LIKOKPCVEZOAOA-DZGCQCFKSA-N 0 3 303.377 3.261 20 70 DGIDHN C[C@H]1CN(Cc2ccccc2)C[C@@H]1Nc1nc(C2CC2)ns1 ZINC000160230789 197393555 /nfs/dbraw/zinc/39/35/55/197393555.db2.gz WKQVHUQDKMLQTN-WFASDCNBSA-N 0 3 314.458 3.348 20 70 DGIDHN Cc1cc(C)cc(CCC(=O)N2CCC[C@@H]3CN(C)CC[C@H]32)c1 ZINC000159766602 197362541 /nfs/dbraw/zinc/36/25/41/197362541.db2.gz TUIURURAJQJWPU-RTBURBONSA-N 0 3 314.473 3.179 20 70 DGIDHN c1coc(-c2nc(CN[C@H]3[C@H]4CCO[C@@H]4C34CCC4)cs2)c1 ZINC000159466521 197355921 /nfs/dbraw/zinc/35/59/21/197355921.db2.gz DJBLXAUBFGTDPZ-SNPRPXQTSA-N 0 3 316.426 3.450 20 70 DGIDHN C[C@H](CC(=O)N1CC[C@H]2CC[C@@H](C1)N2C)c1ccc(F)cc1F ZINC000159443287 197354225 /nfs/dbraw/zinc/35/42/25/197354225.db2.gz INKHMPDDBPGGSS-YUELXQCFSA-N 0 3 322.399 3.154 20 70 DGIDHN CC[C@@H](C(=O)N[C@H]1CCSc2ccc(Cl)cc21)N(C)C ZINC000160095160 276409662 /nfs/dbraw/zinc/40/96/62/276409662.db2.gz CEQGTFODYHJXMB-STQMWFEESA-N 0 3 312.866 3.333 20 70 DGIDHN CN(C)CCN(C(=O)N[C@@H]1CCCc2occc21)C1CCCC1 ZINC000160671103 276785968 /nfs/dbraw/zinc/78/59/68/276785968.db2.gz MEISLZQSSKLLQU-MRXNPFEDSA-N 0 3 319.449 3.173 20 70 DGIDHN C[C@@H](C(=O)NCCc1cc2ccccc2[nH]1)N1[C@H](C)CC[C@@H]1C ZINC000159701927 278207296 /nfs/dbraw/zinc/20/72/96/278207296.db2.gz AKFOBTKKPOMWGT-ZNMIVQPWSA-N 0 3 313.445 3.088 20 70 DGIDHN C[C@@H](c1ccccc1)N(C)C(=O)CN1CCc2ccccc2CC1 ZINC000217223108 432654781 /nfs/dbraw/zinc/65/47/81/432654781.db2.gz OSXZZTBYEZYZGG-KRWDZBQOSA-N 0 3 322.452 3.307 20 70 DGIDHN COc1ccc(C)cc1NC(=O)CN1CC[C@@H]2CCCC[C@@H]21 ZINC000159685694 432692486 /nfs/dbraw/zinc/69/24/86/432692486.db2.gz HYXIPFDFEZMLNI-HOCLYGCPSA-N 0 3 302.418 3.207 20 70 DGIDHN CC[C@@H](C(=O)NCc1ccccc1OCCC(C)C)N(C)C ZINC000160044558 432704878 /nfs/dbraw/zinc/70/48/78/432704878.db2.gz BOLGWMBMOLMDDY-INIZCTEOSA-N 0 3 306.450 3.068 20 70 DGIDHN Cn1ncc2c1CCC[C@@H]2NCCOc1cccc(Cl)c1 ZINC000160262983 432714392 /nfs/dbraw/zinc/71/43/92/432714392.db2.gz ACXPVVQPWAVNGG-HNNXBMFYSA-N 0 3 305.809 3.120 20 70 DGIDHN CC[C@H](N[C@H](CCO)CSC)c1ccccc1OC(F)F ZINC000160329429 432715830 /nfs/dbraw/zinc/71/58/30/432715830.db2.gz QABFRJVCYVDKEG-YPMHNXCESA-N 0 3 319.417 3.443 20 70 DGIDHN Cc1nc2n(n1)C[C@@H](N[C@@H](C)c1oc3ccccc3c1C)CC2 ZINC000160381835 432717844 /nfs/dbraw/zinc/71/78/44/432717844.db2.gz FPLJPYSTOVBEOU-JSGCOSHPSA-N 0 3 310.401 3.307 20 70 DGIDHN COc1ccccc1[C@@H]1CCN(Cc2cnc3ccccn23)C1 ZINC000160551640 432726740 /nfs/dbraw/zinc/72/67/40/432726740.db2.gz SZQCOHIVXCNCQW-OAHLLOKOSA-N 0 3 307.397 3.332 20 70 DGIDHN COc1ccc(CN[C@H]2CCOC(C)(C)C2)c(Cl)c1OC ZINC000160454398 432721491 /nfs/dbraw/zinc/72/14/91/432721491.db2.gz YOMKKXFZFSRMJN-LBPRGKRZSA-N 0 3 313.825 3.404 20 70 DGIDHN Cc1ccccc1CN(C)Cc1cn(C)nc1-c1ccncc1 ZINC000160527065 432725027 /nfs/dbraw/zinc/72/50/27/432725027.db2.gz XUCRNROPBQQKTQ-UHFFFAOYSA-N 0 3 306.413 3.423 20 70 DGIDHN C[C@H](C(=O)NCCc1cc2ccccc2[nH]1)N1CCCCCC1 ZINC000159574033 432688318 /nfs/dbraw/zinc/68/83/18/432688318.db2.gz GWOQTXHYPLGKAK-OAHLLOKOSA-N 0 3 313.445 3.091 20 70 DGIDHN COc1ccc(CNC(=O)CN[C@H](C)c2ccc(C)s2)cc1 ZINC000160956539 432751215 /nfs/dbraw/zinc/75/12/15/432751215.db2.gz WSGHJORCMALDBH-CYBMUJFWSA-N 0 3 318.442 3.032 20 70 DGIDHN O=C(NC[C@H](Cc1ccccc1)c1ccccc1)[C@H]1CCCCN1 ZINC000161071761 432757417 /nfs/dbraw/zinc/75/74/17/432757417.db2.gz SXSAZWQBZVUFRM-VQTJNVASSA-N 0 3 322.452 3.271 20 70 DGIDHN CCN1CCCC[C@H]1CN[C@@H](C)c1cc(OC)ccc1OC ZINC000161165618 432762718 /nfs/dbraw/zinc/76/27/18/432762718.db2.gz PSWPXJHHUZLFKD-GJZGRUSLSA-N 0 3 306.450 3.229 20 70 DGIDHN Cc1ccoc1C(=O)NCCCN[C@H](C)c1ccc(F)cc1F ZINC000161217092 432767200 /nfs/dbraw/zinc/76/72/00/432767200.db2.gz ORWRPHWXRSXMFZ-GFCCVEGCSA-N 0 3 322.355 3.337 20 70 DGIDHN C/C(=C/c1ccccc1Cl)C(=O)NC1CCN(C2CC2)CC1 ZINC000161292173 432771796 /nfs/dbraw/zinc/77/17/96/432771796.db2.gz XEDYNXXJSNEZSB-SEYXRHQNSA-N 0 3 318.848 3.486 20 70 DGIDHN COc1ccc([C@@H](C)NC[C@H](CO)c2ccccc2)c(F)c1 ZINC000161427055 432777816 /nfs/dbraw/zinc/77/78/16/432777816.db2.gz LIKOKPCVEZOAOA-UKRRQHHQSA-N 0 3 303.377 3.261 20 70 DGIDHN CN(Cc1cnc2ccccn12)[C@@H]1CCCN(c2ccccc2)C1 ZINC000160544502 432727512 /nfs/dbraw/zinc/72/75/12/432727512.db2.gz FPKIRGSLFOLYPD-GOSISDBHSA-N 0 3 320.440 3.435 20 70 DGIDHN Cc1nc2n(n1)C[C@H](N[C@H](C)c1cc(C)c(F)c(C)c1)CC2 ZINC000160569379 432729299 /nfs/dbraw/zinc/72/92/99/432729299.db2.gz ONMQXWIIYUHQSE-IUODEOHRSA-N 0 3 302.397 3.008 20 70 DGIDHN CC[C@@H](NCC(=O)Nc1ccc(Br)cc1)C1CC1 ZINC000160782647 432740303 /nfs/dbraw/zinc/74/03/03/432740303.db2.gz DNMSFSVKKCMBHQ-CYBMUJFWSA-N 0 3 311.223 3.166 20 70 DGIDHN C[C@@H](C(=O)N1CCC(OC(C)(C)C)CC1)N1[C@H](C)CC[C@H]1C ZINC000160968196 292825178 /nfs/dbraw/zinc/82/51/78/292825178.db2.gz XFPUSKIPJLRRGN-KFWWJZLASA-N 0 3 310.482 3.054 20 70 DGIDHN CN(C)Cc1ccc(C(=O)NCCc2ccccc2Cl)cc1 ZINC000161421452 292835129 /nfs/dbraw/zinc/83/51/29/292835129.db2.gz FLMGKRUTJSELFY-UHFFFAOYSA-N 0 3 316.832 3.374 20 70 DGIDHN Cc1ccsc1[C@@H]1C[C@H]1C(=O)NCCN1CCCCCC1 ZINC000161286216 534485876 /nfs/dbraw/zinc/48/58/76/534485876.db2.gz CVRNYXMJUSWAGY-HUUCEWRRSA-N 0 3 306.475 3.152 20 70 DGIDHN CSC[C@H](CCO)N[C@@H](C)c1ccc(OCC(C)C)cc1 ZINC000160285273 525699720 /nfs/dbraw/zinc/69/97/20/525699720.db2.gz VKCBRHAIRJQDSM-HOCLYGCPSA-N 0 3 311.491 3.486 20 70 DGIDHN CSC[C@H](CCO)N[C@@H](C)c1ccc(OC(F)F)cc1 ZINC000160357404 525699870 /nfs/dbraw/zinc/69/98/70/525699870.db2.gz RHOQOBJPGKMULH-JQWIXIFHSA-N 0 3 305.390 3.053 20 70 DGIDHN CC(C)c1ccc(C(=O)NCC(C)(C)N2CCCCC2)cn1 ZINC000161409122 528067742 /nfs/dbraw/zinc/06/77/42/528067742.db2.gz YMMXGBUKYRESNQ-UHFFFAOYSA-N 0 3 303.450 3.199 20 70 DGIDHN C[C@@H](NC[C@@H](O)c1ccc(Cl)cc1Cl)c1cnn(C)c1 ZINC000161436817 197494981 /nfs/dbraw/zinc/49/49/81/197494981.db2.gz WQHLWTKBNUBTHC-YMTOWFKASA-N 0 3 314.216 3.111 20 70 DGIDHN CCN(C(=O)N[C@H]1C[C@H](C)N(Cc2ccccc2)C1)C(C)C ZINC000160313219 197399678 /nfs/dbraw/zinc/39/96/78/197399678.db2.gz XRRPMBSXTXDKRN-RDJZCZTQSA-N 0 3 303.450 3.089 20 70 DGIDHN CCN1CCCN(C(=O)N[C@@H](C)c2cccc(C)c2C)CC1 ZINC000159869446 197370339 /nfs/dbraw/zinc/37/03/39/197370339.db2.gz RNWDCGDNIXSSAN-INIZCTEOSA-N 0 3 303.450 3.102 20 70 DGIDHN C[C@@H](CN[C@@H](C)c1cncs1)N1CCc2ccccc2C1 ZINC000159804405 197365576 /nfs/dbraw/zinc/36/55/76/197365576.db2.gz DHBPUWCGTSURGE-KBPBESRZSA-N 0 3 301.459 3.241 20 70 DGIDHN O=C1CCCN1CCCN[C@@H]1CC2(CCC2)Oc2ccccc21 ZINC000159540225 296318327 /nfs/dbraw/zinc/31/83/27/296318327.db2.gz ILEVOFTVUJDJQR-MRXNPFEDSA-N 0 3 314.429 3.035 20 70 DGIDHN CC[C@@H](NCCN1C(=O)Cc2ccccc21)c1ccc(F)cc1 ZINC000160861680 400736636 /nfs/dbraw/zinc/73/66/36/400736636.db2.gz CZTGTZXNOTUHHE-QGZVFWFLSA-N 0 3 312.388 3.456 20 70 DGIDHN CCN(CC)C(=O)C[C@H](C)N[C@@H]1CCOc2c(Cl)cccc21 ZINC000161289385 276090641 /nfs/dbraw/zinc/09/06/41/276090641.db2.gz PHTATFVWLJISKH-SWLSCSKDSA-N 0 3 324.852 3.400 20 70 DGIDHN C[C@H](CN[C@@H](C)c1cncs1)N1CCc2ccccc2C1 ZINC000159804543 278209059 /nfs/dbraw/zinc/20/90/59/278209059.db2.gz DHBPUWCGTSURGE-KGLIPLIRSA-N 0 3 301.459 3.241 20 70 DGIDHN Cc1ccsc1[C@@H]1C[C@H]1C(=O)N[C@@H](C)CN1CCCCC1 ZINC000161431899 278996892 /nfs/dbraw/zinc/99/68/92/278996892.db2.gz KWWAPSZSRSPTGP-RRFJBIMHSA-N 0 3 306.475 3.151 20 70 DGIDHN CCc1ccc([C@@H](CNC(=O)N(C)CC2CCC2)N(C)C)cc1 ZINC000217148428 432655169 /nfs/dbraw/zinc/65/51/69/432655169.db2.gz AVDIMUNVZQTUSO-GOSISDBHSA-N 0 3 317.477 3.293 20 70 DGIDHN CCCN1CCCN(C(=O)CC/C=C/c2ccccc2)CC1 ZINC000159926647 432701248 /nfs/dbraw/zinc/70/12/48/432701248.db2.gz MGOUPOHXPQVWOA-IZZDOVSWSA-N 0 3 300.446 3.424 20 70 DGIDHN O=C(CN[C@@H]1CCC[C@H]1c1ccccc1)NCc1ccccc1 ZINC000160075267 432707455 /nfs/dbraw/zinc/70/74/55/432707455.db2.gz YRIYTWXIAAOFMA-RBUKOAKNSA-N 0 3 308.425 3.229 20 70 DGIDHN CC[C@@H](NCCS(=O)(=O)c1ccc(F)cc1)c1ccccc1 ZINC000160549894 432726387 /nfs/dbraw/zinc/72/63/87/432726387.db2.gz DHWFLJDIZGDEQD-QGZVFWFLSA-N 0 3 321.417 3.340 20 70 DGIDHN CSC[C@@H](CCO)N[C@@H](C)c1cccc(OC(F)F)c1 ZINC000160249515 432712029 /nfs/dbraw/zinc/71/20/29/432712029.db2.gz FVRCYCPUULOCQO-CMPLNLGQSA-N 0 3 305.390 3.053 20 70 DGIDHN COC[C@@H](NCc1ccc(N2CCCCCC2)nc1)C(C)C ZINC000160546641 432726464 /nfs/dbraw/zinc/72/64/64/432726464.db2.gz GHPQOQFWJVPRFO-QGZVFWFLSA-N 0 3 305.466 3.223 20 70 DGIDHN CC1(NC(=O)NCC2CCN(Cc3cccs3)CC2)CCC1 ZINC000160317838 432713781 /nfs/dbraw/zinc/71/37/81/432713781.db2.gz CEOKXUBBHSFILX-UHFFFAOYSA-N 0 3 321.490 3.202 20 70 DGIDHN Cc1nc2n(n1)C[C@H](N[C@@H](C)c1sc(C(C)C)nc1C)CC2 ZINC000160358124 432716268 /nfs/dbraw/zinc/71/62/68/432716268.db2.gz UCDLZPAOWDZVIP-GXFFZTMASA-N 0 3 319.478 3.140 20 70 DGIDHN CCN(CC1CC1)C(=O)N[C@@H]1C[C@H](C)N(Cc2ccccc2)C1 ZINC000160404357 432719091 /nfs/dbraw/zinc/71/90/91/432719091.db2.gz XXAUFIUMNAUOLQ-MAUKXSAKSA-N 0 3 315.461 3.091 20 70 DGIDHN COc1cc2c(c(CN[C@@H]3CCOC(C)(C)C3)c1)O[C@H](C)C2 ZINC000160438841 432721044 /nfs/dbraw/zinc/72/10/44/432721044.db2.gz HVGFWUYDCDTKRP-IUODEOHRSA-N 0 3 305.418 3.066 20 70 DGIDHN CC(C)(C)c1nsc(N2CCC[C@@H]2CN2CCCCC2)n1 ZINC000160446421 432721294 /nfs/dbraw/zinc/72/12/94/432721294.db2.gz JFXHHQBFRORYSU-CYBMUJFWSA-N 0 3 308.495 3.290 20 70 DGIDHN C[C@H](C(=O)NCCc1cc2ccccc2o1)[C@@H](N)c1ccccc1 ZINC000160487556 432722777 /nfs/dbraw/zinc/72/27/77/432722777.db2.gz ATPGHCQFVBAUDY-IFXJQAMLSA-N 0 3 322.408 3.428 20 70 DGIDHN Cc1nc2n(n1)C[C@H](N[C@H](C)c1ccc(OC(C)C)cc1)CC2 ZINC000160491452 432723272 /nfs/dbraw/zinc/72/32/72/432723272.db2.gz GQJXJOTVXKUANO-CZUORRHYSA-N 0 3 314.433 3.039 20 70 DGIDHN CCC(CC)CNC(=O)N(CCN(C)C)Cc1ccc(C)o1 ZINC000160534150 432726691 /nfs/dbraw/zinc/72/66/91/432726691.db2.gz OZUIKKSNBZVYJF-UHFFFAOYSA-N 0 3 309.454 3.097 20 70 DGIDHN CCCCc1ccc([C@H](C)NCC(=O)NCC(F)(F)F)cc1 ZINC000160530952 432726711 /nfs/dbraw/zinc/72/67/11/432726711.db2.gz ZHKDICRMWZQCKV-LBPRGKRZSA-N 0 3 316.367 3.358 20 70 DGIDHN Cc1ccccc1CN(C)Cc1cn(C)nc1-c1cccnc1 ZINC000160519760 432724553 /nfs/dbraw/zinc/72/45/53/432724553.db2.gz RKFBHKYOSDJSGW-UHFFFAOYSA-N 0 3 306.413 3.423 20 70 DGIDHN CC[C@@H](CC(=O)NC[C@H]1CCCN(C)C1)c1ccc(C)cc1 ZINC000159509887 432685333 /nfs/dbraw/zinc/68/53/33/432685333.db2.gz OUIHZBIOBNZLIE-SJORKVTESA-N 0 3 302.462 3.337 20 70 DGIDHN CN(Cc1c(Cl)ccc2cccnc21)C[C@@H]1CCC[C@@H]1O ZINC000159558630 432686881 /nfs/dbraw/zinc/68/68/81/432686881.db2.gz RAIGMNYNMMKDQF-BBRMVZONSA-N 0 3 304.821 3.481 20 70 DGIDHN CN(C)Cc1ccc(CNC(=O)c2cccc(Cl)c2F)cc1 ZINC000159560643 432687212 /nfs/dbraw/zinc/68/72/12/432687212.db2.gz FTBAIWXXLFNJIQ-UHFFFAOYSA-N 0 3 320.795 3.471 20 70 DGIDHN Cc1cc(C)c(C(=O)NC[C@H](c2ccccc2)N2CCCC2)[nH]1 ZINC000159665597 432691386 /nfs/dbraw/zinc/69/13/86/432691386.db2.gz CYDLDBDDXKVFDB-QGZVFWFLSA-N 0 3 311.429 3.198 20 70 DGIDHN Cc1ccc([C@H](C)NCCCc2nnc3n2CCCCC3)o1 ZINC000161185579 432764831 /nfs/dbraw/zinc/76/48/31/432764831.db2.gz FLXIEPJZJAITGV-AWEZNQCLSA-N 0 3 302.422 3.189 20 70 DGIDHN CC(C)N(CCN(C)C)C(=O)[C@@H](C)Cc1ccccc1Cl ZINC000161182464 432765350 /nfs/dbraw/zinc/76/53/50/432765350.db2.gz HUDMFPXVTLWAJJ-AWEZNQCLSA-N 0 3 310.869 3.317 20 70 DGIDHN Cc1cc(C)cc(CN2CCC([C@H](O)C(F)(F)F)CC2)c1 ZINC000161454022 432780359 /nfs/dbraw/zinc/78/03/59/432780359.db2.gz NGXOLFWIECJSOD-HNNXBMFYSA-N 0 3 301.352 3.439 20 70 DGIDHN CCCN(CCN(CC)CC)C(=O)Nc1cccc(C(C)=O)c1 ZINC000160541446 432726968 /nfs/dbraw/zinc/72/69/68/432726968.db2.gz UNUQRFUCNVDKFQ-UHFFFAOYSA-N 0 3 319.449 3.475 20 70 DGIDHN COc1cccc(CN[C@@H]2CCOC(C)(C)C2)c1OC(F)F ZINC000160534318 432727669 /nfs/dbraw/zinc/72/76/69/432727669.db2.gz CYMHSDHAABXDTJ-GFCCVEGCSA-N 0 3 315.360 3.344 20 70 DGIDHN COc1ccccc1[C@H]1CCN(Cc2cnc3ccccn23)C1 ZINC000160551772 432728871 /nfs/dbraw/zinc/72/88/71/432728871.db2.gz SZQCOHIVXCNCQW-HNNXBMFYSA-N 0 3 307.397 3.332 20 70 DGIDHN Cn1c(CN[C@H]2CCOC(C)(C)C2)nc2cc(Cl)ccc21 ZINC000160564199 432729517 /nfs/dbraw/zinc/72/95/17/432729517.db2.gz FHFPLYLSPOELOP-LBPRGKRZSA-N 0 3 307.825 3.274 20 70 DGIDHN C[C@@H](NCCCc1nc2c(s1)CCCC2)c1cnccn1 ZINC000160606178 432730438 /nfs/dbraw/zinc/73/04/38/432730438.db2.gz SSIHFLUPFKSEGD-GFCCVEGCSA-N 0 3 302.447 3.095 20 70 DGIDHN CC(C)C[C@@H](NCC(=O)NCC(F)(F)F)c1cccs1 ZINC000160588496 432730471 /nfs/dbraw/zinc/73/04/71/432730471.db2.gz JQOVENHTJWZMOK-SNVBAGLBSA-N 0 3 308.369 3.103 20 70 DGIDHN CCc1ccc(CNC(=O)N(CCN(C)C)C2CCCC2)s1 ZINC000160685642 432736242 /nfs/dbraw/zinc/73/62/42/432736242.db2.gz GRETYFHVMZWLNH-UHFFFAOYSA-N 0 3 323.506 3.326 20 70 DGIDHN CC[C@@]1(C)C[C@@H]1C(=O)NC1CCN(Cc2ccccc2)CC1 ZINC000160843141 432745793 /nfs/dbraw/zinc/74/57/93/432745793.db2.gz PMWJSKHOIQWWCH-MJGOQNOKSA-N 0 3 300.446 3.203 20 70 DGIDHN Cc1ccc(SCCN[C@H]2CCCc3c2cnn3C)cc1 ZINC000160849027 432746204 /nfs/dbraw/zinc/74/62/04/432746204.db2.gz DVRQTHKFBHSEQA-INIZCTEOSA-N 0 3 301.459 3.488 20 70 DGIDHN CCN1CCC(NC(=O)[C@H](C)Cc2ccc(Cl)cc2)CC1 ZINC000160337557 292812739 /nfs/dbraw/zinc/81/27/39/292812739.db2.gz JQBJQABKIWUOBN-CYBMUJFWSA-N 0 3 308.853 3.119 20 70 DGIDHN CCSc1ccccc1[C@@H](C)N[C@@H]1CCc2nc(C)nn2C1 ZINC000160406420 521779869 /nfs/dbraw/zinc/77/98/69/521779869.db2.gz FQIRPANBIZHFTO-TZMCWYRMSA-N 0 3 316.474 3.364 20 70 DGIDHN C[C@H](CN1CCCCC1)NC(=O)[C@@H]1C[C@@H]1c1cccc(F)c1F ZINC000160363625 524330690 /nfs/dbraw/zinc/33/06/90/524330690.db2.gz RMXNDJZVROKPAK-BPLDGKMQSA-N 0 3 322.399 3.059 20 70 DGIDHN CSC[C@@H](CCO)N[C@@H](C)c1ccc(OCC(C)C)cc1 ZINC000160285537 525642115 /nfs/dbraw/zinc/64/21/15/525642115.db2.gz VKCBRHAIRJQDSM-GOEBONIOSA-N 0 3 311.491 3.486 20 70 DGIDHN COCCN(C)CCN[C@@H]1CCSc2c(Cl)cccc21 ZINC000159411748 546053301 /nfs/dbraw/zinc/05/33/01/546053301.db2.gz FRKVCFBUHXDTQB-CQSZACIVSA-N 0 3 314.882 3.045 20 70 DGIDHN CC(C)OC1CCC(NC(=O)[C@H](C)N2CCCCCC2)CC1 ZINC000159510395 546054366 /nfs/dbraw/zinc/05/43/66/546054366.db2.gz FOZADJBOHDXYOZ-GTPINHCMSA-N 0 3 310.482 3.103 20 70 DGIDHN CC1(C)CC[C@@H](N[C@@H]2CCS(=O)(=O)c3ccc(F)cc32)C1 ZINC000160188620 546058801 /nfs/dbraw/zinc/05/88/01/546058801.db2.gz HFLIPCVJTQPIEQ-TZMCWYRMSA-N 0 3 311.422 3.213 20 70 DGIDHN C[C@H](C(=O)NC1CC=CC1)N1CCC(Cc2ccccc2)CC1 ZINC000160844720 546062834 /nfs/dbraw/zinc/06/28/34/546062834.db2.gz AFBDUTUFDNGRKK-MRXNPFEDSA-N 0 3 312.457 3.164 20 70 DGIDHN CCN1CCCN(C(=O)N[C@H](C)c2ccc(Cl)cc2)CC1 ZINC000159530650 186125454 /nfs/dbraw/zinc/12/54/54/186125454.db2.gz SBGAJASWSSJDDW-CYBMUJFWSA-N 0 3 309.841 3.138 20 70 DGIDHN CCN1CCCN(C(=O)N[C@@H](C)c2cc(C)sc2C)CC1 ZINC000159631300 186132154 /nfs/dbraw/zinc/13/21/54/186132154.db2.gz BTJOATIIAVBXRD-ZDUSSCGKSA-N 0 3 309.479 3.163 20 70 DGIDHN C[C@@H](C(=O)NCCc1cc2ccccc2o1)[C@H](N)c1ccccc1 ZINC000160487454 197414506 /nfs/dbraw/zinc/41/45/06/197414506.db2.gz ATPGHCQFVBAUDY-KUHUBIRLSA-N 0 3 322.408 3.428 20 70 DGIDHN Cc1ccccc1[C@H](C)NCc1cccc(CS(C)(=O)=O)c1 ZINC000159374319 197348402 /nfs/dbraw/zinc/34/84/02/197348402.db2.gz HDADHGHBKHOERS-HNNXBMFYSA-N 0 3 317.454 3.390 20 70 DGIDHN COc1cc(Cl)ccc1CNC(=O)[C@@H](C)N1CCCCCC1 ZINC000217194246 165376982 /nfs/dbraw/zinc/37/69/82/165376982.db2.gz PLMJNHNLMQRASB-CYBMUJFWSA-N 0 3 324.852 3.229 20 70 DGIDHN CC(C)C[C@@H]1COCCN1CC1CCN(C(=O)C(C)(C)C)CC1 ZINC000159679125 432692721 /nfs/dbraw/zinc/69/27/21/432692721.db2.gz IVOMHEJTNSZALF-QGZVFWFLSA-N 0 3 324.509 3.018 20 70 DGIDHN CC[C@H](C)c1cc(C(=O)NC[C@H](C)N2CCC[C@H](C)C2)on1 ZINC000160548143 432726265 /nfs/dbraw/zinc/72/62/65/432726265.db2.gz WMTVEKHJRRBPCT-IHRRRGAJSA-N 0 3 307.438 3.038 20 70 DGIDHN OCC1(CNCc2ccccc2OC(F)(F)F)CCCC1 ZINC000160075777 432706498 /nfs/dbraw/zinc/70/64/98/432706498.db2.gz XYSRWGMWZJGNJE-UHFFFAOYSA-N 0 3 303.324 3.228 20 70 DGIDHN CC(C)N(C(=O)N[C@@H]1C[C@H](C)N(Cc2ccccc2)C1)C1CC1 ZINC000160139531 432708922 /nfs/dbraw/zinc/70/89/22/432708922.db2.gz KVEDNBZZQPOXLN-DOTOQJQBSA-N 0 3 315.461 3.232 20 70 DGIDHN CSC[C@H](CCO)N[C@@H]1CCCOc2c(Cl)cccc21 ZINC000160205725 432710080 /nfs/dbraw/zinc/71/00/80/432710080.db2.gz KOPOPGXNOXMFMR-SMDDNHRTSA-N 0 3 315.866 3.257 20 70 DGIDHN CCC(C)(C)NC(=O)N[C@H]1C[C@@H](C)N(Cc2ccccc2)C1 ZINC000160291723 432713152 /nfs/dbraw/zinc/71/31/52/432713152.db2.gz FPUYKMVCEUYKQI-ZBFHGGJFSA-N 0 3 303.450 3.137 20 70 DGIDHN Cc1nc2n(n1)C[C@@H](N[C@@H](C)c1sc(C(C)C)nc1C)CC2 ZINC000160358353 432715434 /nfs/dbraw/zinc/71/54/34/432715434.db2.gz UCDLZPAOWDZVIP-GWCFXTLKSA-N 0 3 319.478 3.140 20 70 DGIDHN CCN1CCC(NC(=O)/C(C)=C/c2ccccc2Cl)CC1 ZINC000160336097 432715892 /nfs/dbraw/zinc/71/58/92/432715892.db2.gz GPRWBHJTOCRWDQ-OUKQBFOZSA-N 0 3 306.837 3.344 20 70 DGIDHN CC[C@H](C)CN(CC)[C@@H](C)C(=O)NCc1cccc(OC)c1 ZINC000160523277 432725375 /nfs/dbraw/zinc/72/53/75/432725375.db2.gz PBCNUWYJZXULEM-GJZGRUSLSA-N 0 3 306.450 3.068 20 70 DGIDHN Cc1ccc(C(=O)CCN2CC[C@H](C)[C@H](n3ccnc3)C2)cc1 ZINC000160885428 432747846 /nfs/dbraw/zinc/74/78/46/432747846.db2.gz FWVSOJKNDNVPFW-FUHWJXTLSA-N 0 3 311.429 3.347 20 70 DGIDHN C[C@H](CSC(C)(C)C)N[C@@H](C)C(=O)NCc1ccccc1 ZINC000161194092 432764539 /nfs/dbraw/zinc/76/45/39/432764539.db2.gz WZPAXYQFZFLYER-KGLIPLIRSA-N 0 3 308.491 3.201 20 70 DGIDHN C[C@@H](c1ccncc1)N(C)CC1CCN(C(=O)C(C)(C)C)CC1 ZINC000161187244 432765891 /nfs/dbraw/zinc/76/58/91/432765891.db2.gz MHFUCXWPGIVHRO-HNNXBMFYSA-N 0 3 317.477 3.359 20 70 DGIDHN Cc1ccoc1C(=O)NCCCN[C@@H](C)c1cc(F)ccc1F ZINC000161213056 432767232 /nfs/dbraw/zinc/76/72/32/432767232.db2.gz XMTOOWCWUVYNKM-LBPRGKRZSA-N 0 3 322.355 3.337 20 70 DGIDHN CC[C@H](C)CN(CC)[C@@H](C)C(=O)Nc1ccc(OC)c(OC)c1 ZINC000160537494 432726851 /nfs/dbraw/zinc/72/68/51/432726851.db2.gz JHCUPODBUMZGHB-KBPBESRZSA-N 0 3 322.449 3.399 20 70 DGIDHN Cc1cccc2c(CCC(=O)NCCN3CCCCC3)c[nH]c21 ZINC000160570536 432728819 /nfs/dbraw/zinc/72/88/19/432728819.db2.gz LAEZCTVKGBWDDU-UHFFFAOYSA-N 0 3 313.445 3.011 20 70 DGIDHN O=C(Nc1cccc(F)n1)[C@H]1CCCN(Cc2ccccc2)C1 ZINC000160633549 432731601 /nfs/dbraw/zinc/73/16/01/432731601.db2.gz BXDNBHZGCAICIF-HNNXBMFYSA-N 0 3 313.376 3.071 20 70 DGIDHN CCCC[C@H](COC)N[C@H](CN1CCCC1=O)c1ccccc1 ZINC000160735692 432738268 /nfs/dbraw/zinc/73/82/68/432738268.db2.gz KDRZYKOOEQVZRR-QZTJIDSGSA-N 0 3 318.461 3.145 20 70 DGIDHN CN(C)Cc1ccc(C(=O)Nc2nnc(C(C)(C)C)s2)cc1 ZINC000160823326 432744658 /nfs/dbraw/zinc/74/46/58/432744658.db2.gz YKUOZQPGVYEGDY-UHFFFAOYSA-N 0 3 318.446 3.150 20 70 DGIDHN CC[C@]1(C)C[C@H]1C(=O)N(Cc1ccco1)C1CCN(C)CC1 ZINC000160849453 432746477 /nfs/dbraw/zinc/74/64/77/432746477.db2.gz JZWXRUZAEPVDMV-FUHWJXTLSA-N 0 3 304.434 3.139 20 70 DGIDHN CC(C)[C@@H](CNC(=O)[C@@H](C)N)Cc1ccc(Cl)cc1Cl ZINC000159533080 292794403 /nfs/dbraw/zinc/79/44/03/292794403.db2.gz DHEXJXLWDXELNT-ZYHUDNBSSA-N 0 3 317.260 3.272 20 70 DGIDHN CC(C)N(CCN(C)C)C(=O)[C@@H](C)Cc1ccc(Cl)cc1 ZINC000161184522 292830961 /nfs/dbraw/zinc/83/09/61/292830961.db2.gz KCARDJQHRMXOLU-AWEZNQCLSA-N 0 3 310.869 3.317 20 70 DGIDHN COc1cc([C@H](C)N[C@@H](CCO)CSC)ccc1SC ZINC000160334069 522947931 /nfs/dbraw/zinc/94/79/31/522947931.db2.gz MLBFNOMOSQOSJY-AAEUAGOBSA-N 0 3 315.504 3.182 20 70 DGIDHN CCS[C@H]1CCCC[C@@H]1NC(=O)N(CCN(C)C)C(C)C ZINC000159489078 529226327 /nfs/dbraw/zinc/22/63/27/529226327.db2.gz PMSYQQZMICDHEG-GJZGRUSLSA-N 0 3 315.527 3.032 20 70 DGIDHN C[C@@H](C(=O)NC1CC=CC1)N1CCC(Cc2ccccc2)CC1 ZINC000160844599 546063094 /nfs/dbraw/zinc/06/30/94/546063094.db2.gz AFBDUTUFDNGRKK-INIZCTEOSA-N 0 3 312.457 3.164 20 70 DGIDHN Cc1cccc(N2CCN(C(=O)CC3CCCCC3)CC2)n1 ZINC000159566130 186127349 /nfs/dbraw/zinc/12/73/49/186127349.db2.gz HLJGGMSZJSQWPC-UHFFFAOYSA-N 0 3 301.434 3.009 20 70 DGIDHN Cc1c([C@@H](C)NCCC(C)(C)O)cnn1-c1ccc(F)cc1 ZINC000159571714 186127901 /nfs/dbraw/zinc/12/79/01/186127901.db2.gz ZCOTZGVXVMBZBG-GFCCVEGCSA-N 0 3 305.397 3.131 20 70 DGIDHN Cc1ccccc1[C@H](C)NCCNC(=O)c1c(F)cccc1F ZINC000159609143 186130844 /nfs/dbraw/zinc/13/08/44/186130844.db2.gz VNTAEVQMRPKCJG-ZDUSSCGKSA-N 0 3 318.367 3.354 20 70 DGIDHN N[C@@H](Cc1ccccc1)C(=O)N[C@H]1CCC[C@@H]1c1ccccc1 ZINC000159716170 186137456 /nfs/dbraw/zinc/13/74/56/186137456.db2.gz MKZDECCDSRMEJD-QYZOEREBSA-N 0 3 308.425 3.009 20 70 DGIDHN C[C@H](NC[C@](C)(O)c1ccsc1)c1ccc([S@](C)=O)cc1 ZINC000160036769 197381412 /nfs/dbraw/zinc/38/14/12/197381412.db2.gz OHPZMLYWNDMUJE-LBJGKRIESA-N 0 3 323.483 3.044 20 70 DGIDHN C[C@]1(c2ccccc2)CCCN(C(=O)C2(N)CCCCC2)C1 ZINC000160105586 197386058 /nfs/dbraw/zinc/38/60/58/197386058.db2.gz QBBJEWWBFRQBRQ-SFHVURJKSA-N 0 3 300.446 3.228 20 70 DGIDHN CCN1CCCN(C(=O)N[C@H](C)c2cccc(C)c2C)CC1 ZINC000159869588 197370483 /nfs/dbraw/zinc/37/04/83/197370483.db2.gz RNWDCGDNIXSSAN-MRXNPFEDSA-N 0 3 303.450 3.102 20 70 DGIDHN Cc1cc(C)cc(CCC(=O)N2CCC[C@@H]3CN(C)CC[C@@H]32)c1 ZINC000159766422 197362891 /nfs/dbraw/zinc/36/28/91/197362891.db2.gz TUIURURAJQJWPU-MOPGFXCFSA-N 0 3 314.473 3.179 20 70 DGIDHN CCN1CCCC[C@@H]1CNC(=O)CC/C=C/c1ccccc1 ZINC000159764413 400731414 /nfs/dbraw/zinc/73/14/14/400731414.db2.gz OOZRUWXISGDPAW-NORHQAJESA-N 0 3 300.446 3.471 20 70 DGIDHN CCN(Cc1ccc(OC)cc1)C[C@@H]1COc2ccccc2O1 ZINC000217391168 165378676 /nfs/dbraw/zinc/37/86/76/165378676.db2.gz CHQGRJDRMDWICJ-QGZVFWFLSA-N 0 3 313.397 3.357 20 70 DGIDHN CN(C)Cc1cccc(C(=O)NCCc2cc3ccccc3[nH]2)c1 ZINC000159520863 228241753 /nfs/dbraw/zinc/24/17/53/228241753.db2.gz OQYNTIKXLDFOQM-UHFFFAOYSA-N 0 3 321.424 3.202 20 70 DGIDHN Fc1cc(F)cc(CNC[C@H](c2ccco2)N2CCCC2)c1 ZINC000159569738 228242685 /nfs/dbraw/zinc/24/26/85/228242685.db2.gz XRRNJYCNHGRJNV-MRXNPFEDSA-N 0 3 306.356 3.485 20 70 DGIDHN C(c1noc2c1CCCC2)N1CCN(CC2CCCCC2)CC1 ZINC000217027851 432653458 /nfs/dbraw/zinc/65/34/58/432653458.db2.gz CTLLYEAZDQUQQE-UHFFFAOYSA-N 0 3 317.477 3.251 20 70 DGIDHN CCc1ccc(CNCc2cc3c(c(OC)c2)OCO3)s1 ZINC000218215973 432659020 /nfs/dbraw/zinc/65/90/20/432659020.db2.gz AKOGSMZJJMKTMS-UHFFFAOYSA-N 0 3 305.399 3.338 20 70 DGIDHN Brc1ccccc1CN[C@@H]1[C@@H]2CCO[C@@H]2C12CCC2 ZINC000159658194 432692422 /nfs/dbraw/zinc/69/24/22/432692422.db2.gz ANUSOBZIWFOLAA-CFVMTHIKSA-N 0 3 322.246 3.496 20 70 DGIDHN CCSCCN(Cc1cccc(OC)c1)C[C@H]1CCCO1 ZINC000159654858 432692666 /nfs/dbraw/zinc/69/26/66/432692666.db2.gz YMNBVSNUZRPIIC-QGZVFWFLSA-N 0 3 309.475 3.429 20 70 DGIDHN Cc1cccc([C@H]2CCCN2C[C@H](O)c2ccccc2F)n1 ZINC000159868157 432698687 /nfs/dbraw/zinc/69/86/87/432698687.db2.gz HTVZDXRLJKFLQU-MSOLQXFVSA-N 0 3 300.377 3.400 20 70 DGIDHN CSC[C@H](CCO)N[C@@H](C)c1cc(C)ccc1OC(F)F ZINC000160214105 432711298 /nfs/dbraw/zinc/71/12/98/432711298.db2.gz ZQDODXBOOKVBIM-RYUDHWBXSA-N 0 3 319.417 3.361 20 70 DGIDHN Cn1ncc2c1CCC[C@H]2NCCOc1cccc(Cl)c1 ZINC000160262836 432712906 /nfs/dbraw/zinc/71/29/06/432712906.db2.gz ACXPVVQPWAVNGG-OAHLLOKOSA-N 0 3 305.809 3.120 20 70 DGIDHN Cc1nc2n(n1)C[C@@H](N[C@H](C)c1sc(C(C)C)nc1C)CC2 ZINC000160358230 432715601 /nfs/dbraw/zinc/71/56/01/432715601.db2.gz UCDLZPAOWDZVIP-MFKMUULPSA-N 0 3 319.478 3.140 20 70 DGIDHN O=C(NCC1(c2cccs2)CCCCC1)[C@@H]1CCCCN1 ZINC000160496360 432723346 /nfs/dbraw/zinc/72/33/46/432723346.db2.gz VKAGDNWGGAPMLP-AWEZNQCLSA-N 0 3 306.475 3.208 20 70 DGIDHN CC[C@@H](C)CN(CC)[C@@H](C)C(=O)NCc1cccc(OC)c1 ZINC000160523154 432724659 /nfs/dbraw/zinc/72/46/59/432724659.db2.gz PBCNUWYJZXULEM-CABCVRRESA-N 0 3 306.450 3.068 20 70 DGIDHN Cc1ccccc1[C@@H](C)N[C@H](C)C(=O)NCCc1ccccc1 ZINC000159419111 432682742 /nfs/dbraw/zinc/68/27/42/432682742.db2.gz OXPUMWQFWCJERZ-IAGOWNOFSA-N 0 3 310.441 3.393 20 70 DGIDHN COc1cccc(CN[C@H]2CCOC(C)(C)C2)c1OC(F)F ZINC000160534442 432727540 /nfs/dbraw/zinc/72/75/40/432727540.db2.gz CYMHSDHAABXDTJ-LBPRGKRZSA-N 0 3 315.360 3.344 20 70 DGIDHN C[C@H](NC[C@H]1CCCC[C@@H]1O)c1cnn(Cc2ccccc2)c1 ZINC000160601229 432730959 /nfs/dbraw/zinc/73/09/59/432730959.db2.gz PABYKGWXLXLMAB-WDYCEAGBSA-N 0 3 313.445 3.133 20 70 DGIDHN Cc1ccc(CN(C)Cc2cn(C)nc2-c2ccncc2)cc1 ZINC000160640046 432731934 /nfs/dbraw/zinc/73/19/34/432731934.db2.gz MNOJNTINURWAKK-UHFFFAOYSA-N 0 3 306.413 3.423 20 70 DGIDHN CC(C)COCCN[C@@H](C)c1cnn(Cc2ccccc2)c1 ZINC000160710745 432737684 /nfs/dbraw/zinc/73/76/84/432737684.db2.gz LYIUUOAKWRSQHZ-INIZCTEOSA-N 0 3 301.434 3.255 20 70 DGIDHN Cc1ncc([C@H](C)NC[C@H](C)N(C)Cc2ccccc2)c(C)n1 ZINC000160862805 432746446 /nfs/dbraw/zinc/74/64/46/432746446.db2.gz XTBUQTUNRUVXAK-GJZGRUSLSA-N 0 3 312.461 3.265 20 70 DGIDHN CC[C@H](C(=O)NCC1(c2ccc(Cl)cc2)CCC1)N(C)C ZINC000161152152 292829451 /nfs/dbraw/zinc/82/94/51/292829451.db2.gz VMMRSBZLLBIKSA-OAHLLOKOSA-N 0 3 308.853 3.218 20 70 DGIDHN O[C@@H](C1CCN(Cc2cccc3cccnc32)CC1)C(F)(F)F ZINC000161221161 292831613 /nfs/dbraw/zinc/83/16/13/292831613.db2.gz VPNCDBGMOZSRNY-INIZCTEOSA-N 0 3 324.346 3.370 20 70 DGIDHN Cc1ccsc1CCCC(=O)NC1CCN(C2CC2)CC1 ZINC000160242153 534460821 /nfs/dbraw/zinc/46/08/21/534460821.db2.gz OMLAMRJQYJCNIN-UHFFFAOYSA-N 0 3 306.475 3.122 20 70 DGIDHN Cc1nccc(NC(=O)N(CCN(C)C)C2CCCC2)c1Cl ZINC000159753214 546056326 /nfs/dbraw/zinc/05/63/26/546056326.db2.gz BKEAHDRFWQWYGR-UHFFFAOYSA-N 0 3 324.856 3.382 20 70 DGIDHN COc1ccc(Cl)cc1CN1CCN(c2ccncc2)CC1 ZINC000161369855 546067823 /nfs/dbraw/zinc/06/78/23/546067823.db2.gz PLGRPUOTBIFQHE-UHFFFAOYSA-N 0 3 317.820 3.066 20 70 DGIDHN CCOc1ccccc1[C@H](C)NCCNC(=O)OC(C)(C)C ZINC000218166048 627104741 /nfs/dbraw/zinc/10/47/41/627104741.db2.gz POAWUTSRXWXUAJ-ZDUSSCGKSA-N 0 3 308.422 3.261 20 70 DGIDHN CCc1ccccc1C(=O)NC[C@@H](Cc1ccccc1)N(C)C ZINC000160713371 529567751 /nfs/dbraw/zinc/56/77/51/529567751.db2.gz ZVWDCQQYJLLIER-GOSISDBHSA-N 0 3 310.441 3.152 20 70 DGIDHN CCc1ccc([C@H](C)NC(=O)N2CCCN(CC)CC2)cc1 ZINC000159531570 529720370 /nfs/dbraw/zinc/72/03/70/529720370.db2.gz WCZDOMYPWIZFNN-HNNXBMFYSA-N 0 3 303.450 3.047 20 70 DGIDHN CS[C@H]1CCC[C@@H](NC(=O)[C@H](C)[C@@H](N)c2ccccc2)C1 ZINC000159573246 186128089 /nfs/dbraw/zinc/12/80/89/186128089.db2.gz TVPHYJMYTSMDGJ-DMRZNYOFSA-N 0 3 306.475 3.113 20 70 DGIDHN CSCCCCC(=O)N[C@@H]1CCCN(Cc2ccccc2)C1 ZINC000159706413 186136928 /nfs/dbraw/zinc/13/69/28/186136928.db2.gz HJLDNMQSAVHULQ-QGZVFWFLSA-N 0 3 320.502 3.301 20 70 DGIDHN N[C@H](Cc1ccccc1)C(=O)N[C@@H]1CCC[C@@H]1c1ccccc1 ZINC000159718404 186137498 /nfs/dbraw/zinc/13/74/98/186137498.db2.gz MKZDECCDSRMEJD-GUDVDZBRSA-N 0 3 308.425 3.009 20 70 DGIDHN Cc1nc2n(n1)C[C@@H](N[C@H](C)c1cccc(C(F)(F)F)c1)CC2 ZINC000160483941 197414525 /nfs/dbraw/zinc/41/45/25/197414525.db2.gz WTDDDWKAANNNNB-YGRLFVJLSA-N 0 3 324.350 3.271 20 70 DGIDHN CSCC[C@H](N)C(=O)NCC(C)(C)CCCc1ccccc1 ZINC000160122638 197386843 /nfs/dbraw/zinc/38/68/43/197386843.db2.gz XAWJWOJUGBPOBA-INIZCTEOSA-N 0 3 322.518 3.232 20 70 DGIDHN CCN(CC)Cc1cccc(NC(=O)[C@H]2CCC(=O)C[C@@H]2C)c1 ZINC000159840907 197368073 /nfs/dbraw/zinc/36/80/73/197368073.db2.gz NUJRFQRYMIEARC-KSSFIOAISA-N 0 3 316.445 3.472 20 70 DGIDHN CN(Cc1ccccc1)CC(C)(C)NCc1nccn1C(F)F ZINC000159375833 197349219 /nfs/dbraw/zinc/34/92/19/197349219.db2.gz QPUNWHUCFQQYAH-UHFFFAOYSA-N 0 3 322.403 3.278 20 70 DGIDHN Cc1nc(CCNCc2cccc3c2OC(C)(C)C3)cs1 ZINC000217793952 165377978 /nfs/dbraw/zinc/37/79/78/165377978.db2.gz JGABJWJJBOUHOF-UHFFFAOYSA-N 0 3 302.443 3.497 20 70 DGIDHN OCC[C@H]1CCCCN1Cc1cccc(OC(F)(F)F)c1 ZINC000159741268 432694174 /nfs/dbraw/zinc/69/41/74/432694174.db2.gz BAMNVNKVZMWNCJ-CYBMUJFWSA-N 0 3 303.324 3.322 20 70 DGIDHN CC(C)N(C(=O)N[C@H]1C[C@@H](C)N(Cc2ccccc2)C1)C1CC1 ZINC000160139136 432708803 /nfs/dbraw/zinc/70/88/03/432708803.db2.gz KVEDNBZZQPOXLN-WBVHZDCISA-N 0 3 315.461 3.232 20 70 DGIDHN O=C(NCCN1CCCCCC1)[C@H]1C[C@@H]1c1cc(F)ccc1F ZINC000160221170 432711931 /nfs/dbraw/zinc/71/19/31/432711931.db2.gz UQLOKILOWNWIIS-ZBFHGGJFSA-N 0 3 322.399 3.061 20 70 DGIDHN CC[C@H](CN[C@@H]1CCCc2c1cnn2C)Oc1ccccc1F ZINC000160338615 432716466 /nfs/dbraw/zinc/71/64/66/432716466.db2.gz YODPGMGJHRKPTC-CZUORRHYSA-N 0 3 317.408 3.384 20 70 DGIDHN COc1ccc2c(c1)[C@H](NC[C@H]1CCCC[C@@H]1O)CCCO2 ZINC000160467338 432723249 /nfs/dbraw/zinc/72/32/49/432723249.db2.gz SYJYVUGJBZWZAX-XYPHTWIQSA-N 0 3 305.418 3.050 20 70 DGIDHN Cc1nc2ccccn2c1CN1CCN(C)CC12CCCCC2 ZINC000160897379 432748111 /nfs/dbraw/zinc/74/81/11/432748111.db2.gz KSEJGVNCULXTGR-UHFFFAOYSA-N 0 3 312.461 3.093 20 70 DGIDHN CC(C)S(=O)(=O)CCCN1CCC[C@H]1C1CCCCC1 ZINC000160920677 432749468 /nfs/dbraw/zinc/74/94/68/432749468.db2.gz XSAWFJUIOORKRG-INIZCTEOSA-N 0 3 301.496 3.244 20 70 DGIDHN CC(C)NC(=O)CN[C@@H](CCc1ccccc1)Cc1ccccc1 ZINC000160984473 432752671 /nfs/dbraw/zinc/75/26/71/432752671.db2.gz CHGPPPUAPLGDFY-FQEVSTJZSA-N 0 3 324.468 3.345 20 70 DGIDHN CCCN(CC1CCC(C)(C)CC1)[C@@H]1CCS(=O)(=O)C1 ZINC000161095983 432759331 /nfs/dbraw/zinc/75/93/31/432759331.db2.gz ORKGDRJFJHAJRC-OAHLLOKOSA-N 0 3 301.496 3.102 20 70 DGIDHN C[C@@H](NCCCc1nnc2n1CCCCC2)c1ccccc1F ZINC000161129850 432760943 /nfs/dbraw/zinc/76/09/43/432760943.db2.gz JWXKLPZPUOFFDG-CQSZACIVSA-N 0 3 316.424 3.427 20 70 DGIDHN Cc1ccsc1[C@@H]1C[C@@H]1C(=O)NCCN1CCCCCC1 ZINC000161286002 432771549 /nfs/dbraw/zinc/77/15/49/432771549.db2.gz CVRNYXMJUSWAGY-CABCVRRESA-N 0 3 306.475 3.152 20 70 DGIDHN CCC(CC)CNC(=O)N(Cc1ccco1)C1CCN(C)CC1 ZINC000160547055 432727383 /nfs/dbraw/zinc/72/73/83/432727383.db2.gz QKMGHHUTAZZORL-UHFFFAOYSA-N 0 3 321.465 3.322 20 70 DGIDHN COc1cc([C@H](C)NCCOCC(C)C)cc(OC)c1OC ZINC000160693333 432736058 /nfs/dbraw/zinc/73/60/58/432736058.db2.gz PNPYLVKPKBBOFH-ZDUSSCGKSA-N 0 3 311.422 3.036 20 70 DGIDHN CC[C@@H](NC1CCC(NC(C)=O)CC1)c1ccc(F)cc1F ZINC000160865209 432746133 /nfs/dbraw/zinc/74/61/33/432746133.db2.gz LCWVJMWKJSGMFM-MQBCKMQZSA-N 0 3 310.388 3.453 20 70 DGIDHN CSC[C@H](CCO)N[C@@H](C)c1cccc(C(F)(F)F)c1 ZINC000160316515 525698961 /nfs/dbraw/zinc/69/89/61/525698961.db2.gz KBLZFSRDIHVYRE-GWCFXTLKSA-N 0 3 307.381 3.470 20 70 DGIDHN CCN1CCCN(C(=O)NC[C@H](c2ccccc2)C(C)C)CC1 ZINC000159679484 529026554 /nfs/dbraw/zinc/02/65/54/529026554.db2.gz YGZASCHNBNCQOE-SFHVURJKSA-N 0 3 317.477 3.163 20 70 DGIDHN CN(C)Cc1ccc(C(=O)NCCc2cc3ccccc3[nH]2)cc1 ZINC000159602199 546055533 /nfs/dbraw/zinc/05/55/33/546055533.db2.gz VYYMLHPKXNSSAY-UHFFFAOYSA-N 0 3 321.424 3.202 20 70 DGIDHN Cc1cc(C(=O)N(CCN(C)C)Cc2cccc(C)c2)oc1C ZINC000159988782 546057567 /nfs/dbraw/zinc/05/75/67/546057567.db2.gz GYAYOIPVRWDIAX-UHFFFAOYSA-N 0 3 314.429 3.409 20 70 DGIDHN CC1(C)CC[C@@H](N[C@H]2CCS(=O)(=O)c3ccc(F)cc32)C1 ZINC000160188884 546059426 /nfs/dbraw/zinc/05/94/26/546059426.db2.gz HFLIPCVJTQPIEQ-OCCSQVGLSA-N 0 3 311.422 3.213 20 70 DGIDHN Cc1nc2n(n1)C[C@@H](N[C@@H](C)c1cc(C)c(F)c(C)c1)CC2 ZINC000160569765 282117487 /nfs/dbraw/zinc/11/74/87/282117487.db2.gz ONMQXWIIYUHQSE-WFASDCNBSA-N 0 3 302.397 3.008 20 70 DGIDHN CCC(CC)c1cc(C(=O)N[C@H](C)CN2CCCCC2)on1 ZINC000160361962 282285857 /nfs/dbraw/zinc/28/58/57/282285857.db2.gz NNMAYVVAIQCQGM-CYBMUJFWSA-N 0 3 307.438 3.182 20 70 DGIDHN CCN1CCCN(C(=O)N[C@@H](C)c2ccc(Cl)cc2)CC1 ZINC000159530521 186125696 /nfs/dbraw/zinc/12/56/96/186125696.db2.gz SBGAJASWSSJDDW-ZDUSSCGKSA-N 0 3 309.841 3.138 20 70 DGIDHN CS[C@H]1CCC[C@@H](NC(=O)[C@H](C)[C@H](N)c2ccccc2)C1 ZINC000159572959 186127519 /nfs/dbraw/zinc/12/75/19/186127519.db2.gz TVPHYJMYTSMDGJ-OJLVUWQFSA-N 0 3 306.475 3.113 20 70 DGIDHN CCn1cc([C@H](C)NC[C@H](C)N2CCc3sccc3C2)cn1 ZINC000159865450 197370382 /nfs/dbraw/zinc/37/03/82/197370382.db2.gz KZWSBMPEOPJHQY-KBPBESRZSA-N 0 3 318.490 3.062 20 70 DGIDHN NC1(C(=O)N2CC[C@@H](c3ccc(Cl)cc3)C2)CCCCC1 ZINC000159813205 197366737 /nfs/dbraw/zinc/36/67/37/197366737.db2.gz SAVBCYPTRNCVOM-CQSZACIVSA-N 0 3 306.837 3.318 20 70 DGIDHN COCCN(C)CCN[C@@H](C)c1ccc(-c2ccccc2)o1 ZINC000159415199 284957897 /nfs/dbraw/zinc/95/78/97/284957897.db2.gz SUPZCWSMQZKQTI-HNNXBMFYSA-N 0 3 302.418 3.175 20 70 DGIDHN CC[C@H](CC(=O)N[C@@H]1CCN(CC2CC2)C1)c1ccc(C)cc1 ZINC000159490396 400729727 /nfs/dbraw/zinc/72/97/27/400729727.db2.gz YGJYLGOMRZKIPQ-IEBWSBKVSA-N 0 3 314.473 3.479 20 70 DGIDHN C[C@H](c1ccc(Cl)c(Cl)c1)N(C)CCN1CCOCC1 ZINC000217137999 165375458 /nfs/dbraw/zinc/37/54/58/165375458.db2.gz AVUBHXRTYHYJMD-GFCCVEGCSA-N 0 3 317.260 3.318 20 70 DGIDHN COc1ccc2ccccc2c1CNC[C@](C)(O)CSC ZINC000217860118 165378224 /nfs/dbraw/zinc/37/82/24/165378224.db2.gz VAXZFZJQAHWCCG-KRWDZBQOSA-N 0 3 305.443 3.052 20 70 DGIDHN Cc1c([C@H](C)NCC(C)(C)O)cnn1-c1cccc(Cl)c1 ZINC000160588536 280254482 /nfs/dbraw/zinc/25/44/82/280254482.db2.gz IUJZOBZDOJLIIO-NSHDSACASA-N 0 3 307.825 3.256 20 70 DGIDHN CN(CCOc1ccc(Cl)cc1)C[C@H](O)Cc1ccccc1 ZINC000218689569 432660270 /nfs/dbraw/zinc/66/02/70/432660270.db2.gz YGQOKRFWBAXQIV-QGZVFWFLSA-N 0 3 319.832 3.254 20 70 DGIDHN C[C@@H](C(=O)NCCc1cc2ccccc2[nH]1)N1[C@H](C)CC[C@H]1C ZINC000159702208 432694208 /nfs/dbraw/zinc/69/42/08/432694208.db2.gz AKFOBTKKPOMWGT-KFWWJZLASA-N 0 3 313.445 3.088 20 70 DGIDHN COCCOc1cccc(CN(C)Cc2ccc(OC)cc2)c1 ZINC000159852138 432698593 /nfs/dbraw/zinc/69/85/93/432698593.db2.gz RHMIBKGXXHXQMG-UHFFFAOYSA-N 0 3 315.413 3.352 20 70 DGIDHN C[C@H](CN[C@@H](C)c1cncc(F)c1)N1CCc2sccc2C1 ZINC000159871791 432700159 /nfs/dbraw/zinc/70/01/59/432700159.db2.gz PAQWXWRKKUFIIX-OLZOCXBDSA-N 0 3 319.449 3.380 20 70 DGIDHN Cc1cccc([C@@H]2CCCN2C[C@H](O)c2ccc(F)cc2)n1 ZINC000159986939 432703194 /nfs/dbraw/zinc/70/31/94/432703194.db2.gz HZWFBHHQNJCUFQ-ROUUACIJSA-N 0 3 300.377 3.400 20 70 DGIDHN c1ccc2c(c1)CC[C@@H]2NCc1ccccc1CN1CCOCC1 ZINC000160440514 432721664 /nfs/dbraw/zinc/72/16/64/432721664.db2.gz MIYKOBDNLKDRMY-NRFANRHFSA-N 0 3 322.452 3.296 20 70 DGIDHN CC[C@@H](C)CN(CC)[C@@H](C)C(=O)N1CCc2sccc2C1 ZINC000160515259 432724540 /nfs/dbraw/zinc/72/45/40/432724540.db2.gz KERJNWJKWQBRNB-KGLIPLIRSA-N 0 3 308.491 3.389 20 70 DGIDHN CCN(CCN[C@@H](C)c1cnn(C(C)C)c1)C(=O)OC(C)(C)C ZINC000159502003 432684995 /nfs/dbraw/zinc/68/49/95/432684995.db2.gz DUFDGEWOBGBPFH-AWEZNQCLSA-N 0 3 324.469 3.372 20 70 DGIDHN CN(Cc1ccc(F)c(Br)c1)C[C@H]1CCC[C@@H]1O ZINC000159483641 432685553 /nfs/dbraw/zinc/68/55/53/432685553.db2.gz ZYZMIPKHSRWBAF-RISCZKNCSA-N 0 3 316.214 3.181 20 70 DGIDHN CC(C)[C@H](CNC(=O)[C@H](C)N)Cc1ccc(Cl)cc1Cl ZINC000159532815 432686048 /nfs/dbraw/zinc/68/60/48/432686048.db2.gz DHEXJXLWDXELNT-JQWIXIFHSA-N 0 3 317.260 3.272 20 70 DGIDHN CN(Cc1cc(Br)ccc1F)C[C@H]1CCC[C@@H]1O ZINC000159584976 432687905 /nfs/dbraw/zinc/68/79/05/432687905.db2.gz RZCFFMZAWQLDLB-YGRLFVJLSA-N 0 3 316.214 3.181 20 70 DGIDHN CN(Cc1cc(Br)ccc1F)C[C@@H]1CCC[C@@H]1O ZINC000159584862 432688506 /nfs/dbraw/zinc/68/85/06/432688506.db2.gz RZCFFMZAWQLDLB-HZMBPMFUSA-N 0 3 316.214 3.181 20 70 DGIDHN COc1cccc(CN(CCOCC2CC2)C[C@@H]2CCCO2)c1 ZINC000159654431 432691799 /nfs/dbraw/zinc/69/17/99/432691799.db2.gz RLCAWWLFXPGQNH-IBGZPJMESA-N 0 3 319.445 3.103 20 70 DGIDHN Cc1ccsc1[C@H](C)NCc1ccccc1CS(C)(=O)=O ZINC000160941065 432750813 /nfs/dbraw/zinc/75/08/13/432750813.db2.gz QUHZTXMEKWJRHD-ZDUSSCGKSA-N 0 3 323.483 3.452 20 70 DGIDHN COc1ccc(CNC(=O)CN[C@H](C)c2sccc2C)cc1 ZINC000160981148 432752805 /nfs/dbraw/zinc/75/28/05/432752805.db2.gz YBPPSRLLLIQJHQ-CYBMUJFWSA-N 0 3 318.442 3.032 20 70 DGIDHN COc1ccc(COCCCN[C@H](C)c2cncc(F)c2)cc1 ZINC000161093485 432759780 /nfs/dbraw/zinc/75/97/80/432759780.db2.gz NJZYPEUEEZDLPC-CQSZACIVSA-N 0 3 318.392 3.487 20 70 DGIDHN CCN1CCCC[C@H]1CN[C@@H](C)c1ccc(OC)cc1OC ZINC000161202347 432766411 /nfs/dbraw/zinc/76/64/11/432766411.db2.gz BUJJGQYTBDASHA-GJZGRUSLSA-N 0 3 306.450 3.229 20 70 DGIDHN CN(C)Cc1ccc(C(=O)Nc2cnc(C(C)(C)C)nc2)cc1 ZINC000161219212 432767014 /nfs/dbraw/zinc/76/70/14/432767014.db2.gz VWFWKZSRFVNAHM-UHFFFAOYSA-N 0 3 312.417 3.088 20 70 DGIDHN Cc1ccc(CN[C@@H](C)c2ccc3c(c2)C(C)(C)C(=O)N3)cn1 ZINC000161274627 432770471 /nfs/dbraw/zinc/77/04/71/432770471.db2.gz XITCQIFEUDCUBE-ZDUSSCGKSA-N 0 3 309.413 3.471 20 70 DGIDHN CCCn1ccc2ccc(NC(=O)[C@@H](N)CCSC)cc21 ZINC000161282595 432772254 /nfs/dbraw/zinc/77/22/54/432772254.db2.gz WNIXMRQMTADJKO-AWEZNQCLSA-N 0 3 305.447 3.070 20 70 DGIDHN C(=C/c1ccccc1)\CN1CCC[C@@H](c2nnc3n2CCC3)C1 ZINC000161398924 432775729 /nfs/dbraw/zinc/77/57/29/432775729.db2.gz CUFXQVWOWXJFGP-MDGVGCGJSA-N 0 3 308.429 3.117 20 70 DGIDHN COc1ccc(OC)c([C@@H](C)NC[C@H](CO)c2ccccc2)c1 ZINC000161426155 432777668 /nfs/dbraw/zinc/77/76/68/432777668.db2.gz OKISFLGWYORYNR-GDBMZVCRSA-N 0 3 315.413 3.131 20 70 DGIDHN COC(CN1CCCCC[C@H]1C[C@H](O)c1cccs1)OC ZINC000161459912 432779980 /nfs/dbraw/zinc/77/99/80/432779980.db2.gz CBLUSKKTBSCTOM-KBPBESRZSA-N 0 3 313.463 3.035 20 70 DGIDHN CCO[C@@H]1C[C@H](N(C)Cc2c(C)nc3ccccn32)C1(C)C ZINC000160570283 432729345 /nfs/dbraw/zinc/72/93/45/432729345.db2.gz LTWWPPFESDDMBT-JKSUJKDBSA-N 0 3 301.434 3.278 20 70 DGIDHN COc1ccc(OC(F)F)c(CN[C@@H]2CCOC(C)(C)C2)c1 ZINC000160586051 432731295 /nfs/dbraw/zinc/73/12/95/432731295.db2.gz LWJCICXGXYTDSU-GFCCVEGCSA-N 0 3 315.360 3.344 20 70 DGIDHN CCCC1(CN[C@@H](C(=O)NC2CC2)c2ccc(F)cc2)CC1 ZINC000160772745 432740670 /nfs/dbraw/zinc/74/06/70/432740670.db2.gz KTMRULLTFSMJGR-MRXNPFEDSA-N 0 3 304.409 3.315 20 70 DGIDHN CCCCN(CC1CCCCCC1)[C@@H]1CCS(=O)(=O)C1 ZINC000160787500 432741436 /nfs/dbraw/zinc/74/14/36/432741436.db2.gz XUOUNKXYMZJEQJ-MRXNPFEDSA-N 0 3 301.496 3.246 20 70 DGIDHN CCC[C@H](NC[C@@H](O)CN(C)C)c1ccc(Cl)cc1Cl ZINC000159431062 292792499 /nfs/dbraw/zinc/79/24/99/292792499.db2.gz ZIGMKHMSHVVIHZ-DOMZBBRYSA-N 0 3 319.276 3.347 20 70 DGIDHN COC[C@@H](Cc1ccccc1)NCc1ccc(OC(C)C)nc1 ZINC000160073716 292806867 /nfs/dbraw/zinc/80/68/67/292806867.db2.gz DWBJGTCGDBXDDF-GOSISDBHSA-N 0 3 314.429 3.216 20 70 DGIDHN CCc1ccc(CNc2ccc(OC3CCN(C)CC3)nc2)o1 ZINC000160136724 292808206 /nfs/dbraw/zinc/80/82/06/292808206.db2.gz NNEPKWHJVFUFFH-UHFFFAOYSA-N 0 3 315.417 3.322 20 70 DGIDHN CC(C)N(CCN(C)C)C(=O)[C@H](C)Cc1ccccc1Cl ZINC000161182589 292830917 /nfs/dbraw/zinc/83/09/17/292830917.db2.gz HUDMFPXVTLWAJJ-CQSZACIVSA-N 0 3 310.869 3.317 20 70 DGIDHN Cc1ccsc1CCCC(=O)N[C@@H](C)CN1CCCCC1 ZINC000161431083 534461372 /nfs/dbraw/zinc/46/13/72/534461372.db2.gz YBHRDGKHLWRPJB-HNNXBMFYSA-N 0 3 308.491 3.370 20 70 DGIDHN C[C@H](CN1CCCCC1)NC(=O)[C@H]1C[C@@H]1c1cccc(F)c1F ZINC000160363882 524332002 /nfs/dbraw/zinc/33/20/02/524332002.db2.gz RMXNDJZVROKPAK-YUELXQCFSA-N 0 3 322.399 3.059 20 70 DGIDHN CC(C)CN1CCO[C@@H](CN[C@@H](C)c2cccc(Cl)c2)C1 ZINC000216641381 575273489 /nfs/dbraw/zinc/27/34/89/575273489.db2.gz MMFGQDFWGQXFLQ-YOEHRIQHSA-N 0 3 310.869 3.347 20 70 DGIDHN C[C@@H](CN[C@@H](C)c1cncs1)N1CCc2sccc2C1 ZINC000159856059 197369205 /nfs/dbraw/zinc/36/92/05/197369205.db2.gz IUWVQNPYLJZYHO-RYUDHWBXSA-N 0 3 307.488 3.302 20 70 DGIDHN CCN(CC)Cc1cccc(NC(=O)[C@@H]2CCC(=O)C[C@H]2C)c1 ZINC000159841045 197367922 /nfs/dbraw/zinc/36/79/22/197367922.db2.gz NUJRFQRYMIEARC-RDTXWAMCSA-N 0 3 316.445 3.472 20 70 DGIDHN CC[C@H](N[C@@H](C)C(=O)NCc1ccco1)c1ccc(F)cc1 ZINC000160833728 400736231 /nfs/dbraw/zinc/73/62/31/400736231.db2.gz JVCHSYQWBRXOJK-LRDDRELGSA-N 0 3 304.365 3.164 20 70 DGIDHN CCc1ccc([C@@H](CO)NCC2=Cc3ccccc3OC2)cc1 ZINC000160786445 292821716 /nfs/dbraw/zinc/82/17/16/292821716.db2.gz HZMAPJWSZLYWBS-LJQANCHMSA-N 0 3 309.409 3.348 20 70 DGIDHN COc1ccc(Cl)cc1CNC(=O)[C@@H](C)N1CCCCCC1 ZINC000217193796 165376197 /nfs/dbraw/zinc/37/61/97/165376197.db2.gz WUDJXLCBXLERAI-CYBMUJFWSA-N 0 3 324.852 3.229 20 70 DGIDHN CCc1ccc([C@H](CNC(=O)N(C)CC2CCC2)N(C)C)cc1 ZINC000217148442 432654855 /nfs/dbraw/zinc/65/48/55/432654855.db2.gz AVDIMUNVZQTUSO-SFHVURJKSA-N 0 3 317.477 3.293 20 70 DGIDHN C[C@H](c1ccccc1)N(C)C(=O)CN1CCc2ccccc2CC1 ZINC000217223113 432655302 /nfs/dbraw/zinc/65/53/02/432655302.db2.gz OSXZZTBYEZYZGG-QGZVFWFLSA-N 0 3 322.452 3.307 20 70 DGIDHN CCC(CC)(CNCc1cc(-c2ccccc2)no1)C(=O)OC ZINC000159654328 432692510 /nfs/dbraw/zinc/69/25/10/432692510.db2.gz ITSMXAFZKKCJLS-UHFFFAOYSA-N 0 3 316.401 3.411 20 70 DGIDHN CN(Cc1ccc(OC(F)(F)F)cc1)C[C@H]1CCC[C@@H]1O ZINC000159853603 432699414 /nfs/dbraw/zinc/69/94/14/432699414.db2.gz YTWHAMXKTXKNFR-OCCSQVGLSA-N 0 3 303.324 3.178 20 70 DGIDHN CCN1CCC(NC(=O)[C@@H](C)Cc2ccc(Cl)cc2)CC1 ZINC000160337424 432716082 /nfs/dbraw/zinc/71/60/82/432716082.db2.gz JQBJQABKIWUOBN-ZDUSSCGKSA-N 0 3 308.853 3.119 20 70 DGIDHN c1nc2ccccn2c1CN1CCC[C@H]1COc1ccccc1 ZINC000160393785 432717400 /nfs/dbraw/zinc/71/74/00/432717400.db2.gz APCCQMBIRRGTHR-INIZCTEOSA-N 0 3 307.397 3.378 20 70 DGIDHN Cc1nc2n(n1)C[C@@H](N[C@H](C)c1ccc(F)cc1Cl)CC2 ZINC000160384927 432718084 /nfs/dbraw/zinc/71/80/84/432718084.db2.gz QTIXETSGPBSYCF-SKDRFNHKSA-N 0 3 308.788 3.045 20 70 DGIDHN C[C@@H](NCc1ccccc1CN1CCOCC1)c1cccs1 ZINC000160454405 432721056 /nfs/dbraw/zinc/72/10/56/432721056.db2.gz VGYRTOMKROVOBQ-OAHLLOKOSA-N 0 3 316.470 3.431 20 70 DGIDHN COCCN(C)CCN[C@H](C)c1nc(-c2ccccc2)cs1 ZINC000159411271 432681087 /nfs/dbraw/zinc/68/10/87/432681087.db2.gz NLQKJWAMNIGSTE-CQSZACIVSA-N 0 3 319.474 3.039 20 70 DGIDHN CC(C)(C)c1nsc(N2CCCC[C@@H](N3CCCC3)C2)n1 ZINC000159389628 432681784 /nfs/dbraw/zinc/68/17/84/432681784.db2.gz CFYVBAZOZWWNEI-CYBMUJFWSA-N 0 3 308.495 3.290 20 70 DGIDHN CCc1ccc(/C=C/C(=O)N(CCN(C)C)Cc2ccco2)o1 ZINC000160968130 432750611 /nfs/dbraw/zinc/75/06/11/432750611.db2.gz XLZCKCIOVQACRX-MDZDMXLPSA-N 0 3 316.401 3.039 20 70 DGIDHN CC(C)[C@H](N[C@@H](C)c1cnn(C)c1)c1ccc2c(c1)OCCO2 ZINC000161026043 432753986 /nfs/dbraw/zinc/75/39/86/432753986.db2.gz ORAXSPVZXULNEH-UGSOOPFHSA-N 0 3 315.417 3.239 20 70 DGIDHN CSCC[C@H](N)C(=O)Nc1ccc(COC2CCCC2)cc1 ZINC000161136449 432761956 /nfs/dbraw/zinc/76/19/56/432761956.db2.gz KRLDAONZDXGZIJ-INIZCTEOSA-N 0 3 322.474 3.165 20 70 DGIDHN CCN(CC)C(=O)C[C@@H](C)N[C@H]1CCOc2c(Cl)cccc21 ZINC000161289493 432771464 /nfs/dbraw/zinc/77/14/64/432771464.db2.gz PHTATFVWLJISKH-DOMZBBRYSA-N 0 3 324.852 3.400 20 70 DGIDHN c1c(CNC2CCC3(CC2)OCCO3)noc1-c1ccccc1 ZINC000161396197 432776372 /nfs/dbraw/zinc/77/63/72/432776372.db2.gz NNRIZPQZMCVECN-UHFFFAOYSA-N 0 3 314.385 3.117 20 70 DGIDHN O=C(NC[C@H](c1ccccc1)N1CCCC1)N[C@@H]1C=CCCC1 ZINC000161394930 432776815 /nfs/dbraw/zinc/77/68/15/432776815.db2.gz XEVPCIJGPOKZHV-QZTJIDSGSA-N 0 3 313.445 3.231 20 70 DGIDHN Cc1cc([C@@H](C)NC(=O)c2ccc(CN(C)C)cc2)c(C)o1 ZINC000161419229 432778427 /nfs/dbraw/zinc/77/84/27/432778427.db2.gz PBCXORVOYMTCIW-CYBMUJFWSA-N 0 3 300.402 3.449 20 70 DGIDHN CCc1nc(CN[C@@H](COc2ccccc2F)C(C)(C)C)n[nH]1 ZINC000160561079 432728710 /nfs/dbraw/zinc/72/87/10/432728710.db2.gz DCYFAIRROWTQOD-AWEZNQCLSA-N 0 3 320.412 3.090 20 70 DGIDHN COc1cc([C@@H](C)NCCOCC(C)C)cc(OC)c1OC ZINC000160693461 432735793 /nfs/dbraw/zinc/73/57/93/432735793.db2.gz PNPYLVKPKBBOFH-CYBMUJFWSA-N 0 3 311.422 3.036 20 70 DGIDHN CCCC[C@H](COC)N[C@@H](CN1CCCC1=O)c1ccccc1 ZINC000160735431 432738921 /nfs/dbraw/zinc/73/89/21/432738921.db2.gz KDRZYKOOEQVZRR-MSOLQXFVSA-N 0 3 318.461 3.145 20 70 DGIDHN CC(C)n1ccnc1CN1CCCN(Cc2ccccc2)CC1 ZINC000160736754 432738942 /nfs/dbraw/zinc/73/89/42/432738942.db2.gz KRVRZUDZQZNLIF-UHFFFAOYSA-N 0 3 312.461 3.172 20 70 DGIDHN CC[C@H](NCC(=O)Nc1ccc(Br)cc1)C1CC1 ZINC000160782528 432740708 /nfs/dbraw/zinc/74/07/08/432740708.db2.gz DNMSFSVKKCMBHQ-ZDUSSCGKSA-N 0 3 311.223 3.166 20 70 DGIDHN O=C(/C=C/c1sc2ccccc2c1Cl)N1CCCNCC1 ZINC000160834528 432744378 /nfs/dbraw/zinc/74/43/78/432744378.db2.gz WTWKFIQDRACHGF-VOTSOKGWSA-N 0 3 320.845 3.390 20 70 DGIDHN CC[C@@]1(C)C[C@@H]1C(=O)N(Cc1ccco1)C1CCN(C)CC1 ZINC000160849343 432745518 /nfs/dbraw/zinc/74/55/18/432745518.db2.gz JZWXRUZAEPVDMV-AEFFLSMTSA-N 0 3 304.434 3.139 20 70 DGIDHN CCCN(CCN(C)C)C(=O)c1ccc(F)cc1C(F)(F)F ZINC000159394332 292791826 /nfs/dbraw/zinc/79/18/26/292791826.db2.gz BNFDOBNRWNXVRO-UHFFFAOYSA-N 0 3 320.330 3.258 20 70 DGIDHN Cc1cccc(CCN[C@@H](C(=O)NC2CC2)c2ccccc2)c1 ZINC000159843470 292801517 /nfs/dbraw/zinc/80/15/17/292801517.db2.gz VONDLEWYDVONLQ-LJQANCHMSA-N 0 3 308.425 3.147 20 70 DGIDHN C[C@@H](Cc1ccccc1F)NC(=O)c1ccc(CN(C)C)cc1 ZINC000160918038 292823713 /nfs/dbraw/zinc/82/37/13/292823713.db2.gz CNFQKDWBUIJYNF-AWEZNQCLSA-N 0 3 314.404 3.248 20 70 DGIDHN CC[C@@H](NCCCN1CCOCC1)c1cccc(Cl)c1F ZINC000161474964 522829002 /nfs/dbraw/zinc/82/90/02/522829002.db2.gz ADHXVCUHDOCOFE-OAHLLOKOSA-N 0 3 314.832 3.242 20 70 DGIDHN C[C@@H](CN1CCCCC1)NC(=O)[C@H]1C[C@@H]1c1cc(F)ccc1F ZINC000160364780 524605323 /nfs/dbraw/zinc/60/53/23/524605323.db2.gz VABQJHQPMZZBQE-BJJXKVORSA-N 0 3 322.399 3.059 20 70 DGIDHN O=C(NCCN1CCCCCC1)[C@@H]1C[C@H]1c1cc(F)ccc1F ZINC000160221271 526310799 /nfs/dbraw/zinc/31/07/99/526310799.db2.gz UQLOKILOWNWIIS-GOEBONIOSA-N 0 3 322.399 3.061 20 70 DGIDHN Cc1nc2n(n1)C[C@@H](N[C@@H](C)c1ccc(CC(C)C)cc1)CC2 ZINC000160299347 527196243 /nfs/dbraw/zinc/19/62/43/527196243.db2.gz GTNBZCJWRDIWNM-KSSFIOAISA-N 0 3 312.461 3.451 20 70 DGIDHN Cc1nc2n(n1)C[C@H](N[C@@H](C)c1ccc(CC(C)C)cc1)CC2 ZINC000160299200 527198054 /nfs/dbraw/zinc/19/80/54/527198054.db2.gz GTNBZCJWRDIWNM-KBXCAEBGSA-N 0 3 312.461 3.451 20 70 DGIDHN Cc1nc2n(n1)C[C@H](N[C@H](C)c1ccc(CC(C)C)cc1)CC2 ZINC000160299488 527198288 /nfs/dbraw/zinc/19/82/88/527198288.db2.gz GTNBZCJWRDIWNM-RDTXWAMCSA-N 0 3 312.461 3.451 20 70 DGIDHN CCC[C@H](N[C@@H]1CCN(C(=O)C2CCCC2)C1)c1ccccn1 ZINC000159385851 546053676 /nfs/dbraw/zinc/05/36/76/546053676.db2.gz IDABNKMTUQIEGW-AEFFLSMTSA-N 0 3 315.461 3.304 20 70 DGIDHN CC(C)OC1CCC(NC(=O)[C@@H](C)N2CCCCCC2)CC1 ZINC000159510255 546054198 /nfs/dbraw/zinc/05/41/98/546054198.db2.gz FOZADJBOHDXYOZ-KLAILNCOSA-N 0 3 310.482 3.103 20 70 DGIDHN Cc1nccn1CCCCN1CCN(c2ccccc2C)CC1 ZINC000161471578 282204050 /nfs/dbraw/zinc/20/40/50/282204050.db2.gz CGYCYYZODOJBPK-UHFFFAOYSA-N 0 3 312.461 3.102 20 70 DGIDHN CSCC[C@H](N)C(=O)N[C@H](CC(C)C)c1ccccc1C ZINC000159692235 186135963 /nfs/dbraw/zinc/13/59/63/186135963.db2.gz MHKVRKHBYUICLG-JKSUJKDBSA-N 0 3 308.491 3.279 20 70 DGIDHN N[C@@H](Cc1ccccc1)C(=O)N[C@@H]1CCC[C@@H]1c1ccccc1 ZINC000159716038 186137200 /nfs/dbraw/zinc/13/72/00/186137200.db2.gz MKZDECCDSRMEJD-CEXWTWQISA-N 0 3 308.425 3.009 20 70 DGIDHN CC[C@@H](NCC1CCN(C(C)=O)CC1)c1ccc(F)cc1F ZINC000160891127 197447734 /nfs/dbraw/zinc/44/77/34/197447734.db2.gz KXXTYENHWYRWPK-QGZVFWFLSA-N 0 3 310.388 3.264 20 70 DGIDHN C[C@@H](NC[C@](C)(O)c1ccsc1)c1ccc2c(c1)OCO2 ZINC000160114692 197387454 /nfs/dbraw/zinc/38/74/54/197387454.db2.gz FFPZPYKAQUQVBE-BZNIZROVSA-N 0 3 305.399 3.035 20 70 DGIDHN c1ccc(CCOC2CCN(CCOCC3CC3)CC2)cc1 ZINC000159714677 228243109 /nfs/dbraw/zinc/24/31/09/228243109.db2.gz YNWNITIFFGUJJY-UHFFFAOYSA-N 0 3 303.446 3.137 20 70 DGIDHN CCC(CC)(CNCc1cccnc1)NC(=O)OC(C)(C)C ZINC000217697422 432655896 /nfs/dbraw/zinc/65/58/96/432655896.db2.gz NBOVTPYAQLJTSI-UHFFFAOYSA-N 0 3 307.438 3.255 20 70 DGIDHN CCN(CC)C(=O)N(C)[C@@H]1CCN(Cc2ccccc2)[C@H](C)C1 ZINC000159998229 432702908 /nfs/dbraw/zinc/70/29/08/432702908.db2.gz VXARNEANPQTFMV-SJLPKXTDSA-N 0 3 317.477 3.433 20 70 DGIDHN CC1(C)C[C@@H](NCc2c(F)cccc2N2CCCC2)CCO1 ZINC000160489420 432723228 /nfs/dbraw/zinc/72/32/28/432723228.db2.gz GXRWDKMKQBTVQK-AWEZNQCLSA-N 0 3 306.425 3.473 20 70 DGIDHN CCCn1c(CN[C@@H]2CCOC(C)(C)C2)nc2ccccc21 ZINC000160522602 432725530 /nfs/dbraw/zinc/72/55/30/432725530.db2.gz IMEWOGKRKGGSMA-CQSZACIVSA-N 0 3 301.434 3.494 20 70 DGIDHN CC(C)N(CCN(C)C)C(=O)N[C@@H](C)[C@H](C)c1ccccc1 ZINC000159387994 432681260 /nfs/dbraw/zinc/68/12/60/432681260.db2.gz KXTBZYPBZSCUQE-HOTGVXAUSA-N 0 3 305.466 3.160 20 70 DGIDHN CCS[C@H]1CCCC[C@H]1NC(=O)N(CCN(C)C)C(C)C ZINC000159489249 432685569 /nfs/dbraw/zinc/68/55/69/432685569.db2.gz PMSYQQZMICDHEG-CABCVRRESA-N 0 3 315.527 3.032 20 70 DGIDHN CN(Cc1ccc(Br)cc1F)C[C@@H]1CCC[C@@H]1O ZINC000159602262 432688070 /nfs/dbraw/zinc/68/80/70/432688070.db2.gz ZOEAUTBTLUGVSF-FZMZJTMJSA-N 0 3 316.214 3.181 20 70 DGIDHN Cc1nn(-c2ccccc2)cc1CN[C@@H]1[C@H]2CCO[C@@H]2C12CCC2 ZINC000159582048 432688854 /nfs/dbraw/zinc/68/88/54/432688854.db2.gz WWWBNLSHJDIMRW-QRVBRYPASA-N 0 3 323.440 3.228 20 70 DGIDHN Cc1cccc(C(=O)NC[C@H](Cc2ccccc2)N(C)C)c1F ZINC000159631903 432690939 /nfs/dbraw/zinc/69/09/39/432690939.db2.gz GGQUFMAEFIWPFZ-INIZCTEOSA-N 0 3 314.404 3.037 20 70 DGIDHN CCn1cc([C@H](C)NC[C@@H](C)N(C)Cc2ccccc2)cn1 ZINC000160872680 432747563 /nfs/dbraw/zinc/74/75/63/432747563.db2.gz SJJBMQBSCBJMSA-CVEARBPZSA-N 0 3 300.450 3.074 20 70 DGIDHN CC(C)S(=O)(=O)CCCN(CC1CCCCC1)C1CC1 ZINC000160936667 432751540 /nfs/dbraw/zinc/75/15/40/432751540.db2.gz ROFNQIWOEGOZQB-UHFFFAOYSA-N 0 3 301.496 3.244 20 70 DGIDHN CC(C)[C@H](N[C@H](C)c1cnn(C)c1)c1ccc2c(c1)OCCO2 ZINC000161026299 432753875 /nfs/dbraw/zinc/75/38/75/432753875.db2.gz ORAXSPVZXULNEH-ACJLOTCBSA-N 0 3 315.417 3.239 20 70 DGIDHN CC(C)N(C)CC(=O)NC1(c2ccc(F)cc2F)CCCC1 ZINC000161103789 432759198 /nfs/dbraw/zinc/75/91/98/432759198.db2.gz YJWFAOVMTCOROV-UHFFFAOYSA-N 0 3 310.388 3.191 20 70 DGIDHN Cc1ccc(CN[C@@H](C)c2ccc(N3CCCC3=O)cc2)cn1 ZINC000161315627 432773195 /nfs/dbraw/zinc/77/31/95/432773195.db2.gz NAUCHKKSRXMERJ-HNNXBMFYSA-N 0 3 309.413 3.368 20 70 DGIDHN O=C(NC[C@H](c1ccccc1)N1CCCC1)N[C@H]1C=CCCC1 ZINC000161394650 432776904 /nfs/dbraw/zinc/77/69/04/432776904.db2.gz XEVPCIJGPOKZHV-ZWKOTPCHSA-N 0 3 313.445 3.231 20 70 DGIDHN Cc1nc2n(n1)C[C@H](N[C@H](C)c1ccc3c(c1)CCCC3)CC2 ZINC000160527786 432726938 /nfs/dbraw/zinc/72/69/38/432726938.db2.gz LCCQHSABNIFMNA-FZKQIMNGSA-N 0 3 310.445 3.131 20 70 DGIDHN CC[C@@H](C)c1cc(C(=O)NC[C@@H](C)N2CCC[C@H](C)C2)on1 ZINC000160547760 432727569 /nfs/dbraw/zinc/72/75/69/432727569.db2.gz WMTVEKHJRRBPCT-BFHYXJOUSA-N 0 3 307.438 3.038 20 70 DGIDHN CN(Cc1ccc(F)cc1)C(=O)CN1CC[C@@H]2CCCC[C@@H]21 ZINC000160567328 432729043 /nfs/dbraw/zinc/72/90/43/432729043.db2.gz BXFVLYLZOAPUSV-RDJZCZTQSA-N 0 3 304.409 3.049 20 70 DGIDHN Cc1ccccc1[C@@H](CC(C)C)NCC(=O)NCC(F)(F)F ZINC000160630277 432732351 /nfs/dbraw/zinc/73/23/51/432732351.db2.gz BISKPIBKHJMZMQ-CQSZACIVSA-N 0 3 316.367 3.350 20 70 DGIDHN CC[C@@H](CSc1ccc(Cl)cc1)NCC(=O)NC(C)C ZINC000160992127 292826409 /nfs/dbraw/zinc/82/64/09/292826409.db2.gz ZBPQHSHGXNFZAQ-ZDUSSCGKSA-N 0 3 314.882 3.325 20 70 DGIDHN COc1cc(CN[C@H](C)CC(F)(F)F)cc(OC)c1OC ZINC000160665008 533900893 /nfs/dbraw/zinc/90/08/93/533900893.db2.gz NUDGJSDIEZMPDF-SECBINFHSA-N 0 3 307.312 3.143 20 70 DGIDHN CCSc1ccccc1[C@@H](C)N[C@H]1CCc2nc(C)nn2C1 ZINC000160406669 521780838 /nfs/dbraw/zinc/78/08/38/521780838.db2.gz FQIRPANBIZHFTO-OCCSQVGLSA-N 0 3 316.474 3.364 20 70 DGIDHN CSC[C@@H](CCO)N[C@H](C)c1ccc(OCC(C)C)cc1 ZINC000160285407 525641588 /nfs/dbraw/zinc/64/15/88/525641588.db2.gz VKCBRHAIRJQDSM-GDBMZVCRSA-N 0 3 311.491 3.486 20 70 DGIDHN CS[C@@H](C)CC(=O)NC1CCN(Cc2cccc(C)c2)CC1 ZINC000159599023 525788936 /nfs/dbraw/zinc/78/89/36/525788936.db2.gz HMRMHJFRLLWGKT-HNNXBMFYSA-N 0 3 320.502 3.217 20 70 DGIDHN Fc1cc(Cl)cc(CNCCCOC[C@H]2CCCO2)c1 ZINC000160822313 526300198 /nfs/dbraw/zinc/30/01/98/526300198.db2.gz JPIYRIUOORHVES-OAHLLOKOSA-N 0 3 301.789 3.154 20 70 DGIDHN Cc1nc2n(n1)C[C@@H](N[C@H](C)c1ccc(CC(C)C)cc1)CC2 ZINC000160299633 527196251 /nfs/dbraw/zinc/19/62/51/527196251.db2.gz GTNBZCJWRDIWNM-KDOFPFPSSA-N 0 3 312.461 3.451 20 70 DGIDHN Cc1nccc(NC(=O)N[C@@H](C)CN2CCC[C@H](C)C2)c1Cl ZINC000159594262 546055256 /nfs/dbraw/zinc/05/52/56/546055256.db2.gz UJYZZSUHPJHQGC-RYUDHWBXSA-N 0 3 324.856 3.285 20 70 DGIDHN CS[C@H]1CCC[C@@H](NC(=O)[C@@H](C)[C@H](N)c2ccccc2)C1 ZINC000159572806 186127773 /nfs/dbraw/zinc/12/77/73/186127773.db2.gz TVPHYJMYTSMDGJ-UKMLZYKCSA-N 0 3 306.475 3.113 20 70 DGIDHN C[C@@H](NC[C@H](C)N1CCc2ccccc2C1)c1cncc(F)c1 ZINC000159826494 197367561 /nfs/dbraw/zinc/36/75/61/197367561.db2.gz RNRZIINIOHOCLA-LSDHHAIUSA-N 0 3 313.420 3.318 20 70 DGIDHN Cc1ccc(-c2cc(CN(C)C[C@H]3CCC[C@@H]3O)on2)cc1 ZINC000159817752 197366244 /nfs/dbraw/zinc/36/62/44/197366244.db2.gz FVWOQEKHOPGULC-QAPCUYQASA-N 0 3 300.402 3.243 20 70 DGIDHN Cc1nc(CNC(C)(C)CN(C)Cc2ccccc2)cs1 ZINC000159381208 197349866 /nfs/dbraw/zinc/34/98/66/197349866.db2.gz VUSXDRRXGHVWQW-UHFFFAOYSA-N 0 3 303.475 3.452 20 70 DGIDHN CC[C@H](NCC(=O)NCCc1ccccc1)c1ccc(F)cc1 ZINC000160835877 400736251 /nfs/dbraw/zinc/73/62/51/400736251.db2.gz QQVOMPDAUARSPW-SFHVURJKSA-N 0 3 314.404 3.225 20 70 DGIDHN COc1ccc2ccccc2c1CNC[C@@](C)(O)CSC ZINC000217860050 165378165 /nfs/dbraw/zinc/37/81/65/165378165.db2.gz VAXZFZJQAHWCCG-QGZVFWFLSA-N 0 3 305.443 3.052 20 70 DGIDHN C[C@H]1C[C@@H](NC(=O)N(C)CC2CCC2)CN1Cc1ccccc1 ZINC000159915069 432701713 /nfs/dbraw/zinc/70/17/13/432701713.db2.gz BKKGCLQSNDLCSW-MAUKXSAKSA-N 0 3 315.461 3.091 20 70 DGIDHN CSC[C@@H](CCO)N[C@H](C)c1cc(C)ccc1OC(F)F ZINC000160214226 432711191 /nfs/dbraw/zinc/71/11/91/432711191.db2.gz ZQDODXBOOKVBIM-VXGBXAGGSA-N 0 3 319.417 3.361 20 70 DGIDHN CC1(NC(=O)NC[C@@H]2CCCN(Cc3cccs3)C2)CCC1 ZINC000160325844 432714351 /nfs/dbraw/zinc/71/43/51/432714351.db2.gz DAKANJRGPNIBIK-AWEZNQCLSA-N 0 3 321.490 3.202 20 70 DGIDHN CC[C@@H](N[C@@H](CCO)CSC)c1ccccc1OC(F)F ZINC000160329323 432715644 /nfs/dbraw/zinc/71/56/44/432715644.db2.gz QABFRJVCYVDKEG-WCQYABFASA-N 0 3 319.417 3.443 20 70 DGIDHN COc1cc([C@@H](C)N[C@H](CCO)CSC)ccc1SC ZINC000160334449 432715844 /nfs/dbraw/zinc/71/58/44/432715844.db2.gz MLBFNOMOSQOSJY-DGCLKSJQSA-N 0 3 315.504 3.182 20 70 DGIDHN COc1cc2c(c(CN[C@H]3CCOC(C)(C)C3)c1)O[C@@H](C)C2 ZINC000160439240 432720386 /nfs/dbraw/zinc/72/03/86/432720386.db2.gz HVGFWUYDCDTKRP-WFASDCNBSA-N 0 3 305.418 3.066 20 70 DGIDHN Cc1c2ccccc2oc1[C@H](C)NCCCN1CCCC1=O ZINC000159495684 432685518 /nfs/dbraw/zinc/68/55/18/432685518.db2.gz DNZXOKNILLDNRG-AWEZNQCLSA-N 0 3 300.402 3.404 20 70 DGIDHN COc1ccc(Cl)cc1CN[C@@H]1[C@H]2CCO[C@@H]2C12CCC2 ZINC000159643773 432690838 /nfs/dbraw/zinc/69/08/38/432690838.db2.gz GSVAAWBFCUHRRA-BMFZPTHFSA-N 0 3 307.821 3.396 20 70 DGIDHN CCn1cc([C@H](C)NC[C@H](C)N(C)Cc2ccccc2)cn1 ZINC000160872938 432746983 /nfs/dbraw/zinc/74/69/83/432746983.db2.gz SJJBMQBSCBJMSA-HOTGVXAUSA-N 0 3 300.450 3.074 20 70 DGIDHN CCN(Cc1cnc2ccccn12)[C@@H](COC)Cc1ccccc1 ZINC000160927052 432749970 /nfs/dbraw/zinc/74/99/70/432749970.db2.gz HHXUCMRMXHPKDU-GOSISDBHSA-N 0 3 323.440 3.414 20 70 DGIDHN CSCC[C@H](N)C(=O)N[C@@H](C)c1cccc(Cl)c1Cl ZINC000160985976 432753116 /nfs/dbraw/zinc/75/31/16/432753116.db2.gz FOQNPOVOGZQWEU-KWQFWETISA-N 0 3 321.273 3.251 20 70 DGIDHN Cc1ccc([C@@H](C)CN[C@@H](C(N)=O)c2ccc(F)cc2)cc1 ZINC000161049928 432756075 /nfs/dbraw/zinc/75/60/75/432756075.db2.gz WYPKAUMNHSJAFI-SUMWQHHRSA-N 0 3 300.377 3.054 20 70 DGIDHN C[C@H]1C[C@@H](N[C@@H]2CCCOc3ccc(F)cc32)CN1C1CC1 ZINC000161267180 432770308 /nfs/dbraw/zinc/77/03/08/432770308.db2.gz UYYJIBIUNAESQS-DXCKQFNASA-N 0 3 304.409 3.254 20 70 DGIDHN CSCC[C@H](N)C(=O)Nc1ccc(C)c(OCCC(C)C)c1 ZINC000161509571 432782912 /nfs/dbraw/zinc/78/29/12/432782912.db2.gz NMHPBYOYECRCIT-HNNXBMFYSA-N 0 3 324.490 3.439 20 70 DGIDHN O=C(Nc1cccc(F)n1)[C@@H]1CCCN(Cc2ccccc2)C1 ZINC000160633690 432731501 /nfs/dbraw/zinc/73/15/01/432731501.db2.gz BXDNBHZGCAICIF-OAHLLOKOSA-N 0 3 313.376 3.071 20 70 DGIDHN Cc1ccc(C)c([C@H]2CCCN2C(=O)C2CCN(C)CC2)c1 ZINC000160665472 432734304 /nfs/dbraw/zinc/73/43/04/432734304.db2.gz JCKZZDXIAKTFRJ-GOSISDBHSA-N 0 3 300.446 3.309 20 70 DGIDHN CC[C@]1(C)C[C@@H]1C(=O)NC1CCN(Cc2ccccc2)CC1 ZINC000160843026 432745383 /nfs/dbraw/zinc/74/53/83/432745383.db2.gz PMWJSKHOIQWWCH-IEBWSBKVSA-N 0 3 300.446 3.203 20 70 DGIDHN Cc1ncc([C@@H](C)NC[C@@H](C)N(C)Cc2ccccc2)c(C)n1 ZINC000160862480 432745972 /nfs/dbraw/zinc/74/59/72/432745972.db2.gz XTBUQTUNRUVXAK-HUUCEWRRSA-N 0 3 312.461 3.265 20 70 DGIDHN CC(C)CSCCCN[C@H](C(=O)NC1CC1)c1ccccc1 ZINC000160028203 292805773 /nfs/dbraw/zinc/80/57/73/292805773.db2.gz PBRUHLUZOIVNBZ-KRWDZBQOSA-N 0 3 320.502 3.375 20 70 DGIDHN C[C@@H](Cc1cccs1)NC(=O)N(CCN(C)C)C1CCCC1 ZINC000160413255 292814288 /nfs/dbraw/zinc/81/42/88/292814288.db2.gz JSMWMGWOJWAIHZ-AWEZNQCLSA-N 0 3 323.506 3.195 20 70 DGIDHN CSC[C@H](CCO)N[C@H](C)c1cccc(C(F)(F)F)c1 ZINC000160316648 525701911 /nfs/dbraw/zinc/70/19/11/525701911.db2.gz KBLZFSRDIHVYRE-MFKMUULPSA-N 0 3 307.381 3.470 20 70 DGIDHN Cc1ccccc1[C@@H](C)N[C@H]1CCN(C(=O)C2CCCC2)C1 ZINC000159820943 546056558 /nfs/dbraw/zinc/05/65/58/546056558.db2.gz KIAAQTRSNVQFGD-WBVHZDCISA-N 0 3 300.446 3.437 20 70 DGIDHN CC(C)CN1CCO[C@@H](CN[C@@H](C)c2ccccc2Cl)C1 ZINC000216641269 575273520 /nfs/dbraw/zinc/27/35/20/575273520.db2.gz MMMJWLJSGUNUQO-GJZGRUSLSA-N 0 3 310.869 3.347 20 70 DGIDHN Cc1nc2n(n1)C[C@H](N[C@H](C)c1ccccc1C(F)(F)F)CC2 ZINC000160450815 282127702 /nfs/dbraw/zinc/12/77/02/282127702.db2.gz CLNAPXGFKQWBEB-ZYHUDNBSSA-N 0 3 324.350 3.271 20 70 DGIDHN CCN1CCCN(C(=O)N[C@H](C)c2cc(C)sc2C)CC1 ZINC000159631413 186131967 /nfs/dbraw/zinc/13/19/67/186131967.db2.gz BTJOATIIAVBXRD-CYBMUJFWSA-N 0 3 309.479 3.163 20 70 DGIDHN C[C@H](NC[C@@](C)(O)c1ccsc1)c1ccc2c(c1)OCO2 ZINC000160114804 197387289 /nfs/dbraw/zinc/38/72/89/197387289.db2.gz FFPZPYKAQUQVBE-MEDUHNTESA-N 0 3 305.399 3.035 20 70 DGIDHN CCN(CC)Cc1cccc(NC(=O)[C@H]2CCC(=O)C[C@H]2C)c1 ZINC000159841184 197367803 /nfs/dbraw/zinc/36/78/03/197367803.db2.gz NUJRFQRYMIEARC-KDOFPFPSSA-N 0 3 316.445 3.472 20 70 DGIDHN C[C@H](CN[C@H](C)c1cncs1)N1CCc2ccccc2C1 ZINC000159804782 197365269 /nfs/dbraw/zinc/36/52/69/197365269.db2.gz DHBPUWCGTSURGE-ZIAGYGMSSA-N 0 3 301.459 3.241 20 70 DGIDHN CC(=O)Nc1cccc(CN(C)Cc2cccc(N(C)C)c2)c1 ZINC000159790407 197364385 /nfs/dbraw/zinc/36/43/85/197364385.db2.gz NDMUIFUDTDZDFV-UHFFFAOYSA-N 0 3 311.429 3.343 20 70 DGIDHN O=C(Nc1ccc(COCc2ccccc2)cc1)[C@H]1CCCCN1 ZINC000159512853 197360124 /nfs/dbraw/zinc/36/01/24/197360124.db2.gz GBRZWEIIFXVBQH-LJQANCHMSA-N 0 3 324.424 3.484 20 70 DGIDHN CC(C)(C)C(=O)N1CCC(CN2Cc3ccccc3C2)CC1 ZINC000159503500 197358554 /nfs/dbraw/zinc/35/85/54/197358554.db2.gz HZWZTUNDKZMJAV-UHFFFAOYSA-N 0 3 300.446 3.287 20 70 DGIDHN CCc1ccc([C@H](C)CC(=O)NC[C@H]2CCCN(C)C2)cc1 ZINC000159514394 400729891 /nfs/dbraw/zinc/72/98/91/400729891.db2.gz DOKJMLONLHGYJG-NVXWUHKLSA-N 0 3 302.462 3.201 20 70 DGIDHN CCc1ccc([C@@H](C)CC(=O)N[C@H]2CCN(CC3CC3)C2)cc1 ZINC000159495170 400730052 /nfs/dbraw/zinc/73/00/52/400730052.db2.gz CWAUEFQNWPPWPZ-KXBFYZLASA-N 0 3 314.473 3.343 20 70 DGIDHN CC[C@H](CC(=O)N[C@H]1CCN(CC2CC2)C1)c1ccc(C)cc1 ZINC000159490634 400730326 /nfs/dbraw/zinc/73/03/26/400730326.db2.gz YGJYLGOMRZKIPQ-MJGOQNOKSA-N 0 3 314.473 3.479 20 70 DGIDHN CCN1CCCC[C@H]1CNC(=O)CC/C=C/c1ccccc1 ZINC000159764586 400731441 /nfs/dbraw/zinc/73/14/41/400731441.db2.gz OOZRUWXISGDPAW-VQANOXKBSA-N 0 3 300.446 3.471 20 70 DGIDHN CC(C)N(CCN(C)C)C(=O)N[C@H]1CC(C)(C)c2ccccc21 ZINC000159789993 432695989 /nfs/dbraw/zinc/69/59/89/432695989.db2.gz BJROJJHFLLDOSR-KRWDZBQOSA-N 0 3 317.477 3.391 20 70 DGIDHN CC[C@H](C(=O)NCc1ccccc1OCCC(C)C)N(C)C ZINC000160044705 432704401 /nfs/dbraw/zinc/70/44/01/432704401.db2.gz BOLGWMBMOLMDDY-MRXNPFEDSA-N 0 3 306.450 3.068 20 70 DGIDHN CC(C)n1cc([C@H](C)NCCN(C)Cc2ccc(F)cc2)cn1 ZINC000160141176 432708906 /nfs/dbraw/zinc/70/89/06/432708906.db2.gz HVKMVXGYOQJEBF-HNNXBMFYSA-N 0 3 318.440 3.386 20 70 DGIDHN CC(C)n1cc([C@@H](C)NCCN(C)Cc2ccc(F)cc2)cn1 ZINC000160141021 432708945 /nfs/dbraw/zinc/70/89/45/432708945.db2.gz HVKMVXGYOQJEBF-OAHLLOKOSA-N 0 3 318.440 3.386 20 70 DGIDHN CSC[C@H](CCO)N[C@H](C)c1ccccc1OC(F)(F)F ZINC000160187093 432710792 /nfs/dbraw/zinc/71/07/92/432710792.db2.gz QUCSLCYEYUALEG-MNOVXSKESA-N 0 3 323.380 3.350 20 70 DGIDHN CSC[C@H](CCO)N[C@H](C)c1ccccc1OC(F)F ZINC000160244446 432712227 /nfs/dbraw/zinc/71/22/27/432712227.db2.gz GKUICQGLURUWJI-MNOVXSKESA-N 0 3 305.390 3.053 20 70 DGIDHN CC[C@H](CN[C@H]1CCCc2c1cnn2C)Oc1ccccc1F ZINC000160338915 432716323 /nfs/dbraw/zinc/71/63/23/432716323.db2.gz YODPGMGJHRKPTC-CJNGLKHVSA-N 0 3 317.408 3.384 20 70 DGIDHN Cc1cc(CN(C)Cc2cccc(F)c2)ccc1-n1cncn1 ZINC000160457217 432721352 /nfs/dbraw/zinc/72/13/52/432721352.db2.gz JCGULPFIFPVHPY-UHFFFAOYSA-N 0 3 310.376 3.347 20 70 DGIDHN CC[C@H](C)CN(CC)[C@@H](C)C(=O)N1CCc2sccc2C1 ZINC000160515398 432724932 /nfs/dbraw/zinc/72/49/32/432724932.db2.gz KERJNWJKWQBRNB-KBPBESRZSA-N 0 3 308.491 3.389 20 70 DGIDHN CCC[C@H](NC[C@H](O)COC)c1ccc(Cl)cc1Cl ZINC000159578719 432688488 /nfs/dbraw/zinc/68/84/88/432688488.db2.gz GDSZWPCFGBBVOB-FZMZJTMJSA-N 0 3 306.233 3.432 20 70 DGIDHN O=C(CN1CC[C@@H]2CCCC[C@@H]21)Nc1ccc(OC(F)F)cc1 ZINC000159660252 432691724 /nfs/dbraw/zinc/69/17/24/432691724.db2.gz OGRGQBRJYJFSRL-WFASDCNBSA-N 0 3 324.371 3.491 20 70 DGIDHN CC[C@H](N)C(=O)N(CC)[C@H](C)c1cccc(C(F)(F)F)c1 ZINC000161116315 432759341 /nfs/dbraw/zinc/75/93/41/432759341.db2.gz LNCPFDODCAZXDI-MFKMUULPSA-N 0 3 302.340 3.352 20 70 DGIDHN OC[C@@H](CN[C@H]1CCCOc2ccc(F)cc21)c1ccccc1 ZINC000161445363 432779130 /nfs/dbraw/zinc/77/91/30/432779130.db2.gz OJTSJTALZVBJTG-QAPCUYQASA-N 0 3 315.388 3.405 20 70 DGIDHN CCCCN(CC1CCC(C)CC1)[C@H]1CCS(=O)(=O)C1 ZINC000160794698 432741919 /nfs/dbraw/zinc/74/19/19/432741919.db2.gz DQMGVFHWJSEBFF-GPANFISMSA-N 0 3 301.496 3.102 20 70 DGIDHN C[C@@H]1C[C@H](NC(=O)NCc2ccccc2)CN1Cc1ccccc1 ZINC000161502579 432783693 /nfs/dbraw/zinc/78/36/93/432783693.db2.gz XGBBYQAEBRXFHP-APWZRJJASA-N 0 3 323.440 3.149 20 70 DGIDHN Cc1cc(C(=O)N(CCN(C)C)Cc2cccc(F)c2)oc1C ZINC000159487440 292793792 /nfs/dbraw/zinc/79/37/92/292793792.db2.gz TTYRHVIARVADOJ-UHFFFAOYSA-N 0 3 318.392 3.240 20 70 DGIDHN CN1CCC(Oc2ccc(NCc3cccs3)cn2)CC1 ZINC000160083691 292806921 /nfs/dbraw/zinc/80/69/21/292806921.db2.gz CDPOATCZWVIRMS-UHFFFAOYSA-N 0 3 303.431 3.228 20 70 DGIDHN COC[C@H](Cc1ccccc1)NCc1ccc(OC(C)C)nc1 ZINC000160073570 292806932 /nfs/dbraw/zinc/80/69/32/292806932.db2.gz DWBJGTCGDBXDDF-SFHVURJKSA-N 0 3 314.429 3.216 20 70 DGIDHN CSCC[C@@H](N)C(=O)NCC(C)(C)CCCc1ccccc1 ZINC000160122524 525543021 /nfs/dbraw/zinc/54/30/21/525543021.db2.gz XAWJWOJUGBPOBA-MRXNPFEDSA-N 0 3 322.518 3.232 20 70 DGIDHN CCC(CC)n1nccc1C(=O)NCC(C)(C)N1CCCCC1 ZINC000161379335 528913032 /nfs/dbraw/zinc/91/30/32/528913032.db2.gz SXZDAEGNSIOFIZ-UHFFFAOYSA-N 0 3 320.481 3.239 20 70 DGIDHN COCCN(C)CCN[C@H]1CCSc2c(Cl)cccc21 ZINC000159411862 546053086 /nfs/dbraw/zinc/05/30/86/546053086.db2.gz FRKVCFBUHXDTQB-AWEZNQCLSA-N 0 3 314.882 3.045 20 70 DGIDHN Cc1ccccc1[C@H](C)N[C@@H]1CCN(C(=O)C2CCCC2)C1 ZINC000159820822 546056648 /nfs/dbraw/zinc/05/66/48/546056648.db2.gz KIAAQTRSNVQFGD-DOTOQJQBSA-N 0 3 300.446 3.437 20 70 DGIDHN Cc1ccc(NC(=O)N2CCN(C3CCC(C)CC3)CC2)cn1 ZINC000161455378 546069174 /nfs/dbraw/zinc/06/91/74/546069174.db2.gz QMULITXIZHJFMJ-UHFFFAOYSA-N 0 3 316.449 3.118 20 70 DGIDHN CCn1nccc1CNCCOc1ccc(C(F)(F)F)cc1 ZINC000160093925 197385700 /nfs/dbraw/zinc/38/57/00/197385700.db2.gz SFVMSQJNQDVIHW-UHFFFAOYSA-N 0 3 313.323 3.090 20 70 DGIDHN CC[C@@H](NCC(=O)NCCc1ccccc1)c1ccc(F)cc1 ZINC000160836002 400736337 /nfs/dbraw/zinc/73/63/37/400736337.db2.gz QQVOMPDAUARSPW-GOSISDBHSA-N 0 3 314.404 3.225 20 70 DGIDHN CC[C@@H](C(=O)N1CCC(CCc2ccccc2)CC1)N(C)C ZINC000160728728 292821244 /nfs/dbraw/zinc/82/12/44/292821244.db2.gz UBYVZLNAMLCLMX-SFHVURJKSA-N 0 3 302.462 3.198 20 70 DGIDHN CC[C@H](NC[C@@H]1CN(CC(C)C)CCO1)c1ccc(C)cc1 ZINC000216641999 165375622 /nfs/dbraw/zinc/37/56/22/165375622.db2.gz BMVKDADCRIFLKB-MOPGFXCFSA-N 0 3 304.478 3.393 20 70 DGIDHN C[C@H](NCc1ccoc1)[C@H]1CCCN(C(=O)OC(C)(C)C)C1 ZINC000218176026 263836110 /nfs/dbraw/zinc/83/61/10/263836110.db2.gz GFYVISCCQOWFAM-ZFWWWQNUSA-N 0 3 308.422 3.405 20 70 DGIDHN Cc1cccc(N2CCN(C[C@@H](O)Cc3ccccc3)CC2)c1C ZINC000218681301 432659987 /nfs/dbraw/zinc/65/99/87/432659987.db2.gz ZPSMZRLAOKDFHA-FQEVSTJZSA-N 0 3 324.468 3.029 20 70 DGIDHN CCOCCCN(Cc1cccc(OC)c1)C[C@H]1CCCO1 ZINC000159655797 432692078 /nfs/dbraw/zinc/69/20/78/432692078.db2.gz ZYWDGFDZMQOVHO-GOSISDBHSA-N 0 3 307.434 3.103 20 70 DGIDHN CC[C@@H](C)c1cc(C(=O)NC[C@H](C)N2CCC[C@H](C)C2)on1 ZINC000160548013 432726280 /nfs/dbraw/zinc/72/62/80/432726280.db2.gz WMTVEKHJRRBPCT-MJBXVCDLSA-N 0 3 307.438 3.038 20 70 DGIDHN CSC[C@@H](CCO)N[C@H](C)c1sc(C(C)C)nc1C ZINC000160201633 432709828 /nfs/dbraw/zinc/70/98/28/432709828.db2.gz WBHVRWODABVNCB-ZYHUDNBSSA-N 0 3 302.509 3.340 20 70 DGIDHN CC[C@@H](N[C@H](CCO)CSC)c1ccccc1OC(F)F ZINC000160329551 432715324 /nfs/dbraw/zinc/71/53/24/432715324.db2.gz QABFRJVCYVDKEG-DGCLKSJQSA-N 0 3 319.417 3.443 20 70 DGIDHN COc1cc([C@H](C)N[C@H](CCO)CSC)ccc1SC ZINC000160334312 432715784 /nfs/dbraw/zinc/71/57/84/432715784.db2.gz MLBFNOMOSQOSJY-WCQYABFASA-N 0 3 315.504 3.182 20 70 DGIDHN CC(C)(O)CN1CCN(CC2CCC(C(C)(C)C)CC2)CC1 ZINC000160427384 432719766 /nfs/dbraw/zinc/71/97/66/432719766.db2.gz YRAUTIQGPVTAQV-UHFFFAOYSA-N 0 3 310.526 3.227 20 70 DGIDHN CN(Cc1cnc2ccccn12)[C@H]1CCCN(c2ccccc2)C1 ZINC000160544625 432726701 /nfs/dbraw/zinc/72/67/01/432726701.db2.gz FPKIRGSLFOLYPD-SFHVURJKSA-N 0 3 320.440 3.435 20 70 DGIDHN CCS[C@H]1CCC[C@H](NC(=O)N(CCN(C)C)C(C)C)C1 ZINC000159421568 432683722 /nfs/dbraw/zinc/68/37/22/432683722.db2.gz GKFFAVNHWIRYDL-GJZGRUSLSA-N 0 3 315.527 3.032 20 70 DGIDHN CC[C@@H](CC(=O)NC[C@@H]1CCCN(C)C1)c1ccc(C)cc1 ZINC000159509637 432685839 /nfs/dbraw/zinc/68/58/39/432685839.db2.gz OUIHZBIOBNZLIE-IRXDYDNUSA-N 0 3 302.462 3.337 20 70 DGIDHN CN(Cc1c(Cl)ccc2cccnc21)C[C@H]1CCC[C@@H]1O ZINC000159558766 432687086 /nfs/dbraw/zinc/68/70/86/432687086.db2.gz RAIGMNYNMMKDQF-CJNGLKHVSA-N 0 3 304.821 3.481 20 70 DGIDHN CCC[C@@H](NC[C@@H](O)COC)c1ccc(Cl)cc1Cl ZINC000159579131 432687675 /nfs/dbraw/zinc/68/76/75/432687675.db2.gz GDSZWPCFGBBVOB-BXUZGUMPSA-N 0 3 306.233 3.432 20 70 DGIDHN O[C@H](CN1CC[C@]2(O)CCCC[C@@H]2C1)c1ccccc1Cl ZINC000161031830 432756223 /nfs/dbraw/zinc/75/62/23/432756223.db2.gz UHFWAHRSMDZRDT-KBRIMQKVSA-N 0 3 309.837 3.000 20 70 DGIDHN CCC(CC)n1ncc(C(=O)N[C@@H](CC(C)C)CN(C)C)c1C ZINC000161173432 432765169 /nfs/dbraw/zinc/76/51/69/432765169.db2.gz XMPYQXXXYFKHSF-HNNXBMFYSA-N 0 3 322.497 3.259 20 70 DGIDHN C[C@@H](c1ccccn1)N(C)CC1CCN(C(=O)C(C)(C)C)CC1 ZINC000161190157 432765712 /nfs/dbraw/zinc/76/57/12/432765712.db2.gz CDVCJKSUJLYKMW-HNNXBMFYSA-N 0 3 317.477 3.359 20 70 DGIDHN C[C@@H]1C[C@@H](N[C@@H]2CCCOc3ccc(F)cc32)CN1C1CC1 ZINC000161267053 432769899 /nfs/dbraw/zinc/76/98/99/432769899.db2.gz UYYJIBIUNAESQS-SUYBPPKGSA-N 0 3 304.409 3.254 20 70 DGIDHN CCO[C@@H]1C[C@H](N[C@@H]2CCCc3c2cnn3C)C1(CC)CC ZINC000161317517 432772804 /nfs/dbraw/zinc/77/28/04/432772804.db2.gz XBAQYZMETAFPJE-HYVNUMGLSA-N 0 3 305.466 3.371 20 70 DGIDHN C(=C/c1ccccc1)\CN1CCC[C@H](c2nnc3n2CCC3)C1 ZINC000161398782 432775970 /nfs/dbraw/zinc/77/59/70/432775970.db2.gz CUFXQVWOWXJFGP-QVNOTHCHSA-N 0 3 308.429 3.117 20 70 DGIDHN CC(=O)Nc1cccc([C@@H](C)NC[C@@H](CO)c2ccccc2)c1 ZINC000161401274 432776207 /nfs/dbraw/zinc/77/62/07/432776207.db2.gz HJFXHBACBGDXEX-KDOFPFPSSA-N 0 3 312.413 3.072 20 70 DGIDHN C[C@@H](NC[C@H](O)c1ccc(Cl)cc1Cl)c1cnn(C)c1 ZINC000161436569 432780226 /nfs/dbraw/zinc/78/02/26/432780226.db2.gz WQHLWTKBNUBTHC-OTYXRUKQSA-N 0 3 314.216 3.111 20 70 DGIDHN CC[C@@H](N[C@H]1CCc2nc(C)nn2C1)c1ccc(Cl)s1 ZINC000160539519 432727298 /nfs/dbraw/zinc/72/72/98/432727298.db2.gz JTJDGNJTMZAYAU-WDEREUQCSA-N 0 3 310.854 3.357 20 70 DGIDHN CC(C)CSCCCNC(=O)c1ccc(CN(C)C)cc1 ZINC000160717682 432737569 /nfs/dbraw/zinc/73/75/69/432737569.db2.gz GXMKTXPXXQITJZ-UHFFFAOYSA-N 0 3 308.491 3.257 20 70 DGIDHN COc1ccccc1C[C@H](C)N(C)Cc1cnc2ccccn12 ZINC000160815947 432743555 /nfs/dbraw/zinc/74/35/55/432743555.db2.gz MQCXIZCVFXYEHK-HNNXBMFYSA-N 0 3 309.413 3.406 20 70 DGIDHN Fc1cc(Cl)cc(CNCCCOC[C@@H]2CCCO2)c1 ZINC000160822155 432744710 /nfs/dbraw/zinc/74/47/10/432744710.db2.gz JPIYRIUOORHVES-HNNXBMFYSA-N 0 3 301.789 3.154 20 70 DGIDHN Cc1ccc(SCCN[C@@H]2CCCc3c2cnn3C)cc1 ZINC000160848899 432746145 /nfs/dbraw/zinc/74/61/45/432746145.db2.gz DVRQTHKFBHSEQA-MRXNPFEDSA-N 0 3 301.459 3.488 20 70 DGIDHN CSCC[C@@H](N)C(=O)Nc1ccc(C)c(OCCC(C)C)c1 ZINC000161509946 432783382 /nfs/dbraw/zinc/78/33/82/432783382.db2.gz NMHPBYOYECRCIT-OAHLLOKOSA-N 0 3 324.490 3.439 20 70 DGIDHN Cc1ccccc1[C@H](C)N[C@@H](C)C(=O)NCCc1ccccc1 ZINC000159418965 292792518 /nfs/dbraw/zinc/79/25/18/292792518.db2.gz OXPUMWQFWCJERZ-IRXDYDNUSA-N 0 3 310.441 3.393 20 70 DGIDHN CCCCn1ncc(NC(=O)N(CCN(C)C)CC(C)C)c1C ZINC000159927979 292803515 /nfs/dbraw/zinc/80/35/15/292803515.db2.gz BUFKMYKYGBONLR-UHFFFAOYSA-N 0 3 323.485 3.043 20 70 DGIDHN C[C@@H](C(=O)NCC(C)(C)N1CCCCC1)c1c(F)cccc1F ZINC000160907724 292823888 /nfs/dbraw/zinc/82/38/88/292823888.db2.gz ICGUWUIOXXAGRD-CYBMUJFWSA-N 0 3 324.415 3.449 20 70 DGIDHN CC(C)(C)c1nsc(N2CC[C@@H](CN3CCCCC3)C2)n1 ZINC000159673885 519140954 /nfs/dbraw/zinc/14/09/54/519140954.db2.gz ATPOLOPUMFFNAZ-ZDUSSCGKSA-N 0 3 308.495 3.148 20 70 DGIDHN CCCN1CCCN(C(=O)CC(C)(C)c2ccccc2)CC1 ZINC000160378034 519848781 /nfs/dbraw/zinc/84/87/81/519848781.db2.gz DPPSKSLOVUQIDZ-UHFFFAOYSA-N 0 3 302.462 3.299 20 70 DGIDHN Cc1cccc(C(=O)NCCCN(C)Cc2ccccc2)c1F ZINC000159692641 534602402 /nfs/dbraw/zinc/60/24/02/534602402.db2.gz LYXTZJJCVPWHMX-UHFFFAOYSA-N 0 3 314.404 3.386 20 70 DGIDHN CCOCCC1(C(=O)NC[C@H](c2ccccc2)N(C)C)CCC1 ZINC000160645279 528605462 /nfs/dbraw/zinc/60/54/62/528605462.db2.gz CGJQNARBLNBZNU-QGZVFWFLSA-N 0 3 318.461 3.002 20 70 DGIDHN CCC[C@@H](Cc1ccccc1)NC(=O)N1CCCN(CC)CC1 ZINC000159814003 528960279 /nfs/dbraw/zinc/96/02/79/528960279.db2.gz PZACYOPJZSQUTD-SFHVURJKSA-N 0 3 317.477 3.135 20 70 DGIDHN CCN1CCCN(C(=O)NCCCCCc2ccccc2)CC1 ZINC000159810801 529022677 /nfs/dbraw/zinc/02/26/77/529022677.db2.gz PCBNOWYHCNOVCY-UHFFFAOYSA-N 0 3 317.477 3.137 20 70 DGIDHN CCN1CCCN(C(=O)N[C@@H](c2ccccc2)C2CCC2)CC1 ZINC000159821190 529028992 /nfs/dbraw/zinc/02/89/92/529028992.db2.gz WBSCEYBCODJBFI-SFHVURJKSA-N 0 3 315.461 3.265 20 70 DGIDHN CCOc1cc2c(cc1CN[C@@H]1CCOC(C)(C)C1)O[C@@H](C)C2 ZINC000160535359 546060841 /nfs/dbraw/zinc/06/08/41/546060841.db2.gz LYUJXKYJZQEUGQ-XJKSGUPXSA-N 0 3 319.445 3.456 20 70 DGIDHN Cc1ccc(NC(=O)N[C@@H](CN2CCCC2)c2ccccc2)cn1 ZINC000161509491 546070144 /nfs/dbraw/zinc/07/01/44/546070144.db2.gz HTOHERWAPRRJSC-SFHVURJKSA-N 0 3 324.428 3.349 20 70 DGIDHN COc1ccc(CCN2CCN(C)C[C@@H]2c2ccccc2)cc1 ZINC000216734969 546262382 /nfs/dbraw/zinc/26/23/82/546262382.db2.gz SKBBMUCVWWMDGY-HXUWFJFHSA-N 0 3 310.441 3.226 20 70 DGIDHN CC(C)CN1CCO[C@H](CN[C@@H](C)c2cc3ccccc3o2)C1 ZINC000216695994 546262796 /nfs/dbraw/zinc/26/27/96/546262796.db2.gz GHBWUIHQWAKJPH-DOTOQJQBSA-N 0 3 316.445 3.440 20 70 DGIDHN CC(C)(C)[C@H](N)C(=O)Nc1ccc(COC2CCCC2)cc1 ZINC000159601870 186130184 /nfs/dbraw/zinc/13/01/84/186130184.db2.gz ODASJDVBSTUSBG-MRXNPFEDSA-N 0 3 304.434 3.458 20 70 DGIDHN CC(C)(C)c1nsc(N2CC[C@@H]3[C@H](CCCN3C3CC3)C2)n1 ZINC000160043935 197381595 /nfs/dbraw/zinc/38/15/95/197381595.db2.gz YZDJXYFLLJUCAH-TZMCWYRMSA-N 0 3 320.506 3.289 20 70 DGIDHN C[C@@]1(c2ccccc2)CCCN(C(=O)C2(N)CCCCC2)C1 ZINC000160105726 197385914 /nfs/dbraw/zinc/38/59/14/197385914.db2.gz QBBJEWWBFRQBRQ-GOSISDBHSA-N 0 3 300.446 3.228 20 70 DGIDHN CCn1cc([C@@H](C)NC[C@H](C)N2CCc3sccc3C2)cn1 ZINC000159865319 197369991 /nfs/dbraw/zinc/36/99/91/197369991.db2.gz KZWSBMPEOPJHQY-UONOGXRCSA-N 0 3 318.490 3.062 20 70 DGIDHN Cc1cc(NC(=O)[C@@H](N)CC(C)C)ccc1OCC(F)(F)F ZINC000159563260 197361581 /nfs/dbraw/zinc/36/15/81/197361581.db2.gz LYKADNULIKIZHQ-LBPRGKRZSA-N 0 3 318.339 3.248 20 70 DGIDHN CC(C)COC[C@H](O)CN[C@@H](C)c1ccc2c(c1)CCCC2 ZINC000218170793 284785851 /nfs/dbraw/zinc/78/58/51/284785851.db2.gz BPMRPPGGMOPIJW-HNAYVOBHSA-N 0 3 305.462 3.250 20 70 DGIDHN CSC[C@@H](CCO)N[C@H]1CCCOc2c(Cl)cccc21 ZINC000160205770 295612294 /nfs/dbraw/zinc/61/22/94/295612294.db2.gz KOPOPGXNOXMFMR-RISCZKNCSA-N 0 3 315.866 3.257 20 70 DGIDHN CN(Cc1ccccc1F)C(=O)CN1CC[C@@H]2CCCC[C@@H]21 ZINC000159620161 400730135 /nfs/dbraw/zinc/73/01/35/400730135.db2.gz ZFKUBXKLAZWUEI-YOEHRIQHSA-N 0 3 304.409 3.049 20 70 DGIDHN Cc1ccsc1CCCC(=O)N1CCN(C2CCCC2)CC1 ZINC000160981244 228250045 /nfs/dbraw/zinc/25/00/45/228250045.db2.gz LQHADUKUFIRDAZ-UHFFFAOYSA-N 0 3 320.502 3.466 20 70 DGIDHN CC(C)(O)CN[C@@H]1CCCOc2c(Br)cccc21 ZINC000160611703 278649007 /nfs/dbraw/zinc/64/90/07/278649007.db2.gz IUKNCYORWBEUSJ-GFCCVEGCSA-N 0 3 314.223 3.023 20 70 DGIDHN C[C@@H](NCc1ccoc1)[C@@H]1CCCN(C(=O)OC(C)(C)C)C1 ZINC000218175762 432657654 /nfs/dbraw/zinc/65/76/54/432657654.db2.gz GFYVISCCQOWFAM-UKRRQHHQSA-N 0 3 308.422 3.405 20 70 DGIDHN CC(C)COC[C@H](O)CN[C@H](C)c1ccc2c(c1)CCCC2 ZINC000218170941 432658228 /nfs/dbraw/zinc/65/82/28/432658228.db2.gz BPMRPPGGMOPIJW-DNVCBOLYSA-N 0 3 305.462 3.250 20 70 DGIDHN CC(C)COC[C@@H](O)CN[C@@H](C)c1ccc2c(c1)CCCC2 ZINC000218170715 432659110 /nfs/dbraw/zinc/65/91/10/432659110.db2.gz BPMRPPGGMOPIJW-KXBFYZLASA-N 0 3 305.462 3.250 20 70 DGIDHN CN(Cc1ccc(C(=O)OC(C)(C)C)cc1)C[C@@H]1CCC[C@@H]1O ZINC000159778221 432695736 /nfs/dbraw/zinc/69/57/36/432695736.db2.gz ONRCTRCZAFNIKR-IRXDYDNUSA-N 0 3 319.445 3.235 20 70 DGIDHN O=C(Nc1ccccc1)c1ccc(CN2CCCC[C@@H]2CO)cc1 ZINC000159826839 432697341 /nfs/dbraw/zinc/69/73/41/432697341.db2.gz YYMKHIOVCNDMMO-LJQANCHMSA-N 0 3 324.424 3.286 20 70 DGIDHN Cc1ccc(C(=O)NC2CCN(CCCOC(C)C)CC2)s1 ZINC000159892623 432699867 /nfs/dbraw/zinc/69/98/67/432699867.db2.gz TYJYVDSKMWSRGL-UHFFFAOYSA-N 0 3 324.490 3.066 20 70 DGIDHN OCC1(CNCc2nc(-c3ccccc3)cs2)CCCC1 ZINC000160087066 432707577 /nfs/dbraw/zinc/70/75/77/432707577.db2.gz HHLLWDUBQAGJDJ-UHFFFAOYSA-N 0 3 302.443 3.452 20 70 DGIDHN CSC[C@H](CCO)N[C@@H](C)c1sc(C(C)C)nc1C ZINC000160201484 432710601 /nfs/dbraw/zinc/71/06/01/432710601.db2.gz WBHVRWODABVNCB-JQWIXIFHSA-N 0 3 302.509 3.340 20 70 DGIDHN CSC[C@H](CCO)N[C@@H](C)c1ccccc1OC(F)F ZINC000160244306 432711348 /nfs/dbraw/zinc/71/13/48/432711348.db2.gz GKUICQGLURUWJI-QWRGUYRKSA-N 0 3 305.390 3.053 20 70 DGIDHN CCN1CCC[C@H]1CNC(=O)[C@@H](C)Cc1cccc(Cl)c1 ZINC000160329799 432714910 /nfs/dbraw/zinc/71/49/10/432714910.db2.gz HSQNYKNOJCYQCD-BBRMVZONSA-N 0 3 308.853 3.119 20 70 DGIDHN CC[C@H](C)c1cc(C(=O)NC[C@H]2CCCN2CC(C)C)on1 ZINC000160403612 432718729 /nfs/dbraw/zinc/71/87/29/432718729.db2.gz RVGRAWCDTAFIJW-UONOGXRCSA-N 0 3 307.438 3.038 20 70 DGIDHN CSc1ccc([C@@H](C)N[C@H]2CCc3nc(C)nn3C2)cc1F ZINC000160405240 432719139 /nfs/dbraw/zinc/71/91/39/432719139.db2.gz UXWSDUUHNKRNSI-MFKMUULPSA-N 0 3 320.437 3.113 20 70 DGIDHN CC(C)N(CCN(C)C)C(=O)N[C@H](C)[C@@H](C)c1ccccc1 ZINC000159387868 432681584 /nfs/dbraw/zinc/68/15/84/432681584.db2.gz KXTBZYPBZSCUQE-HZPDHXFCSA-N 0 3 305.466 3.160 20 70 DGIDHN CCC[C@H](NC[C@@H](O)COC)c1ccc(Cl)cc1Cl ZINC000159578996 432688923 /nfs/dbraw/zinc/68/89/23/432688923.db2.gz GDSZWPCFGBBVOB-RISCZKNCSA-N 0 3 306.233 3.432 20 70 DGIDHN CCOCCCN(Cc1cccc(OC)c1)C[C@@H]1CCCO1 ZINC000159655643 432691868 /nfs/dbraw/zinc/69/18/68/432691868.db2.gz ZYWDGFDZMQOVHO-SFHVURJKSA-N 0 3 307.434 3.103 20 70 DGIDHN CC[C@@H](NCC(=O)NC(C)C)c1ccc2cc(OC)ccc2c1 ZINC000160942688 432751641 /nfs/dbraw/zinc/75/16/41/432751641.db2.gz CWLRUIWBNVCYAD-GOSISDBHSA-N 0 3 314.429 3.414 20 70 DGIDHN CC(C)NC(=O)CN[C@H](CCc1ccccc1)Cc1ccccc1 ZINC000160984598 432752926 /nfs/dbraw/zinc/75/29/26/432752926.db2.gz CHGPPPUAPLGDFY-HXUWFJFHSA-N 0 3 324.468 3.345 20 70 DGIDHN CC[C@H](N)C(=O)Nc1cc(C)ccc1SCC(F)(F)F ZINC000161132735 432760657 /nfs/dbraw/zinc/76/06/57/432760657.db2.gz MOOWTFPORRITOQ-VIFPVBQESA-N 0 3 306.353 3.325 20 70 DGIDHN CCN1CCC(NC(=O)c2cncc(-c3cccc(C)c3)c2)CC1 ZINC000161400045 432775807 /nfs/dbraw/zinc/77/58/07/432775807.db2.gz XVSAAGRYRMPHOV-UHFFFAOYSA-N 0 3 323.440 3.271 20 70 DGIDHN COc1ccc([C@@H](C)NC[C@@H](CO)c2ccccc2)c(F)c1 ZINC000161426858 432777805 /nfs/dbraw/zinc/77/78/05/432777805.db2.gz LIKOKPCVEZOAOA-HIFRSBDPSA-N 0 3 303.377 3.261 20 70 DGIDHN Clc1cccc(CN2CCC[C@@H](c3nnc4n3CCC4)C2)c1 ZINC000161406250 432778363 /nfs/dbraw/zinc/77/83/63/432778363.db2.gz WMLMMKRTIMMZBH-CQSZACIVSA-N 0 3 316.836 3.257 20 70 DGIDHN CC[C@H](C)CN(CC)[C@@H](C)C(=O)NCc1ccccc1OC ZINC000160561752 432729095 /nfs/dbraw/zinc/72/90/95/432729095.db2.gz UHLWLTMVUYMBQS-GJZGRUSLSA-N 0 3 306.450 3.068 20 70 DGIDHN Cc1c([C@H](C)NCC(C)(C)O)cnn1-c1cc(C)ccc1C ZINC000160590200 432731176 /nfs/dbraw/zinc/73/11/76/432731176.db2.gz RFMLLNRWPCGNDI-AWEZNQCLSA-N 0 3 301.434 3.219 20 70 DGIDHN c1nc2ccccn2c1CN1CC[C@@H](COCc2ccccc2)C1 ZINC000160805526 432743168 /nfs/dbraw/zinc/74/31/68/432743168.db2.gz CDSUIFUWMAPQOU-GOSISDBHSA-N 0 3 321.424 3.373 20 70 DGIDHN CC1CCC(CN[C@H](CS(C)(=O)=O)c2ccccc2)CC1 ZINC000159604005 292796328 /nfs/dbraw/zinc/79/63/28/292796328.db2.gz VQFMYFHTCSFBLW-VMBOVVBDSA-N 0 3 309.475 3.188 20 70 DGIDHN CC(C)[C@@H](CO)N(Cc1cnc2ccccn12)Cc1ccccc1 ZINC000160468054 519795341 /nfs/dbraw/zinc/79/53/41/519795341.db2.gz ZFJVXYJNIFGJOD-LJQANCHMSA-N 0 3 323.440 3.353 20 70 DGIDHN CC[C@H](C)N(C)C(=O)N[C@@H]1C[C@H](C)N(Cc2ccccc2)C1 ZINC000160320225 523912086 /nfs/dbraw/zinc/91/20/86/523912086.db2.gz LODCJWSQPAUUFN-YQQAZPJKSA-N 0 3 303.450 3.089 20 70 DGIDHN CSC[C@@H](CCO)N[C@@H](C)c1ccc(OC(F)F)cc1 ZINC000160357644 525641502 /nfs/dbraw/zinc/64/15/02/525641502.db2.gz RHOQOBJPGKMULH-CMPLNLGQSA-N 0 3 305.390 3.053 20 70 DGIDHN CSC[C@H](CCO)N[C@H](C)c1cccc(OC(F)(F)F)c1 ZINC000160411727 525700731 /nfs/dbraw/zinc/70/07/31/525700731.db2.gz OASULHXOQSDAPU-PWSUYJOCSA-N 0 3 323.380 3.350 20 70 DGIDHN CC(C)c1ccc(C(=O)NC[C@@H](c2ccccc2)N(C)C)cn1 ZINC000159701527 528070486 /nfs/dbraw/zinc/07/04/86/528070486.db2.gz SZJDKWUNVINVTQ-SFHVURJKSA-N 0 3 311.429 3.238 20 70 DGIDHN CCN1CCC(N(C)C(=O)c2ccc3nc(C)ccc3c2)CC1 ZINC000161454928 528971329 /nfs/dbraw/zinc/97/13/29/528971329.db2.gz BKDLNWSWHKENOC-UHFFFAOYSA-N 0 3 311.429 3.100 20 70 DGIDHN Cc1nccc(NC(=O)N[C@H](C)CN2CCC[C@H](C)C2)c1Cl ZINC000159594380 546055148 /nfs/dbraw/zinc/05/51/48/546055148.db2.gz UJYZZSUHPJHQGC-NWDGAFQWSA-N 0 3 324.856 3.285 20 70 DGIDHN Cc1ccccc1[C@H](C)N[C@H]1CCN(C(=O)C2CCCC2)C1 ZINC000159821071 546056189 /nfs/dbraw/zinc/05/61/89/546056189.db2.gz KIAAQTRSNVQFGD-RDJZCZTQSA-N 0 3 300.446 3.437 20 70 DGIDHN CC1(C)CC[C@H](N[C@H]2CCS(=O)(=O)c3ccc(F)cc32)C1 ZINC000160188761 546059397 /nfs/dbraw/zinc/05/93/97/546059397.db2.gz HFLIPCVJTQPIEQ-JSGCOSHPSA-N 0 3 311.422 3.213 20 70 DGIDHN Cc1nc2ccccn2c1CN1CC[C@@H](OCCC(C)C)C1 ZINC000161302984 546067453 /nfs/dbraw/zinc/06/74/53/546067453.db2.gz DCKATUOQDLBPTP-MRXNPFEDSA-N 0 3 301.434 3.280 20 70 DGIDHN Cc1nc2n(n1)C[C@@H](N[C@H](C)c1ccccc1C(F)(F)F)CC2 ZINC000160450959 282118798 /nfs/dbraw/zinc/11/87/98/282118798.db2.gz CLNAPXGFKQWBEB-PWSUYJOCSA-N 0 3 324.350 3.271 20 70 DGIDHN C[C@@H](N[C@@H]1CCCSC1)c1cnn(Cc2ccccc2)c1 ZINC000159624178 186131533 /nfs/dbraw/zinc/13/15/33/186131533.db2.gz FIRHHTLJDPRPBC-RHSMWYFYSA-N 0 3 301.459 3.478 20 70 DGIDHN C[C@H](N[C@H]1CCCSC1)c1cnn(Cc2ccccc2)c1 ZINC000159624280 186131550 /nfs/dbraw/zinc/13/15/50/186131550.db2.gz FIRHHTLJDPRPBC-YOEHRIQHSA-N 0 3 301.459 3.478 20 70 DGIDHN COc1ccc([C@@H](NCCc2cnn(C)c2)c2ccccc2)cc1 ZINC000159756425 186139865 /nfs/dbraw/zinc/13/98/65/186139865.db2.gz KSCKCMWDKWMKEP-FQEVSTJZSA-N 0 3 321.424 3.350 20 70 DGIDHN C[C@@H](NCCN(C)Cc1ccc(F)cc1)c1cncc(F)c1 ZINC000160135003 197388317 /nfs/dbraw/zinc/38/83/17/197388317.db2.gz OAUOGGGFRSTPIQ-CYBMUJFWSA-N 0 3 305.372 3.142 20 70 DGIDHN C[C@@H](NC[C@](C)(O)c1ccsc1)c1ccc([S@@](C)=O)cc1 ZINC000160037166 197380690 /nfs/dbraw/zinc/38/06/90/197380690.db2.gz OHPZMLYWNDMUJE-PKQAIAMASA-N 0 3 323.483 3.044 20 70 DGIDHN Cc1cc(C(=O)NCc2cccc(CN(C)C)c2)cc(Cl)n1 ZINC000159984106 197378170 /nfs/dbraw/zinc/37/81/70/197378170.db2.gz OHOSNDNRIJJSSU-UHFFFAOYSA-N 0 3 317.820 3.035 20 70 DGIDHN COc1ccc(CN(C)Cc2cn(C)nc2-c2cccnc2)cc1 ZINC000159856093 197369467 /nfs/dbraw/zinc/36/94/67/197369467.db2.gz DOIFITGRVPOJOV-UHFFFAOYSA-N 0 3 322.412 3.123 20 70 DGIDHN CCc1oc2ccccc2c1CN1CCC(CC(N)=O)CC1 ZINC000159768922 197362569 /nfs/dbraw/zinc/36/25/69/197362569.db2.gz PFEQVWRSUVBMGK-UHFFFAOYSA-N 0 3 300.402 3.083 20 70 DGIDHN CC(C)COC[C@@H](O)CN[C@H](C)c1ccc2c(c1)CCCC2 ZINC000218170882 284785793 /nfs/dbraw/zinc/78/57/93/284785793.db2.gz BPMRPPGGMOPIJW-BEFAXECRSA-N 0 3 305.462 3.250 20 70 DGIDHN CCc1ccc([C@H](C)CC(=O)NC[C@@H]2CCCN(C)C2)cc1 ZINC000159514104 400729971 /nfs/dbraw/zinc/72/99/71/400729971.db2.gz DOKJMLONLHGYJG-WBVHZDCISA-N 0 3 302.462 3.201 20 70 DGIDHN CCS[C@@H]1CCC[C@H](NC(=O)N(CCN(C)C)C(C)C)C1 ZINC000159421482 286711952 /nfs/dbraw/zinc/71/19/52/286711952.db2.gz GKFFAVNHWIRYDL-LSDHHAIUSA-N 0 3 315.527 3.032 20 70 DGIDHN CCCO[C@H]1CCCN(Cc2cc(C)c(C(=O)OC)o2)CC1 ZINC000217005561 165376304 /nfs/dbraw/zinc/37/63/04/165376304.db2.gz XZZTWWWFRRSOCT-AWEZNQCLSA-N 0 3 309.406 3.156 20 70 DGIDHN CC[C@@H](NC[C@H]1CN(CC(C)C)CCO1)c1ccc(C)cc1 ZINC000216642039 165376668 /nfs/dbraw/zinc/37/66/68/165376668.db2.gz BMVKDADCRIFLKB-RBUKOAKNSA-N 0 3 304.478 3.393 20 70 DGIDHN CCn1cc([C@H](C)NC[C@@H](C)N2CCc3sccc3C2)cn1 ZINC000159865179 281631541 /nfs/dbraw/zinc/63/15/41/281631541.db2.gz KZWSBMPEOPJHQY-KGLIPLIRSA-N 0 3 318.490 3.062 20 70 DGIDHN CCSCCN(Cc1cccc(OC)c1)C[C@@H]1CCCO1 ZINC000159654721 432692640 /nfs/dbraw/zinc/69/26/40/432692640.db2.gz YMNBVSNUZRPIIC-KRWDZBQOSA-N 0 3 309.475 3.429 20 70 DGIDHN Cc1cccc([C@H](C)C(=O)NC[C@H](C)N2CCC[C@H](C)C2)c1 ZINC000159874369 432699133 /nfs/dbraw/zinc/69/91/33/432699133.db2.gz WZYNCJKXRPUQCM-ULQDDVLXSA-N 0 3 302.462 3.335 20 70 DGIDHN CN(C)c1cccc(CN(C)Cc2cc3ccccc3[nH]c2=O)c1 ZINC000159852717 432700218 /nfs/dbraw/zinc/70/02/18/432700218.db2.gz OHVSDLFBXQDSQW-UHFFFAOYSA-N 0 3 321.424 3.226 20 70 DGIDHN C[C@H](Cc1ccccc1F)C(=O)N(CCN(C)C)C1CCCC1 ZINC000160059111 432705647 /nfs/dbraw/zinc/70/56/47/432705647.db2.gz ILHHJIYZUAOHEM-OAHLLOKOSA-N 0 3 320.452 3.337 20 70 DGIDHN CSC[C@@H](CCO)N[C@H](C)c1ccccc1OC(F)F ZINC000160244694 432711746 /nfs/dbraw/zinc/71/17/46/432711746.db2.gz GKUICQGLURUWJI-GHMZBOCLSA-N 0 3 305.390 3.053 20 70 DGIDHN O=C(NCCN1CCCCCC1)[C@@H]1C[C@H]1c1cccc(F)c1F ZINC000160220452 432712125 /nfs/dbraw/zinc/71/21/25/432712125.db2.gz KSFXZKFAKALJHD-LSDHHAIUSA-N 0 3 322.399 3.061 20 70 DGIDHN CC[C@@H](CN[C@@H]1CCCc2c1cnn2C)Oc1ccccc1F ZINC000160338506 432716312 /nfs/dbraw/zinc/71/63/12/432716312.db2.gz YODPGMGJHRKPTC-XJKSGUPXSA-N 0 3 317.408 3.384 20 70 DGIDHN CSc1ccc([C@H](C)N[C@@H]2CCc3nc(C)nn3C2)cc1F ZINC000160404844 432719606 /nfs/dbraw/zinc/71/96/06/432719606.db2.gz UXWSDUUHNKRNSI-GXFFZTMASA-N 0 3 320.437 3.113 20 70 DGIDHN Cc1nc2n(n1)C[C@H](N[C@@H](C)c1ccccc1C(F)(F)F)CC2 ZINC000160450564 432720989 /nfs/dbraw/zinc/72/09/89/432720989.db2.gz CLNAPXGFKQWBEB-CMPLNLGQSA-N 0 3 324.350 3.271 20 70 DGIDHN COCCN(Cc1ccccc1)Cc1ccc(NC(C)=O)cc1 ZINC000160444690 432721715 /nfs/dbraw/zinc/72/17/15/432721715.db2.gz YIIPKMNADUCZHY-UHFFFAOYSA-N 0 3 312.413 3.294 20 70 DGIDHN COCCN(Cc1ccccc1)Cc1ccc(OC)c(OC)c1 ZINC000160448049 432721940 /nfs/dbraw/zinc/72/19/40/432721940.db2.gz NFGDNDSFQNJFPN-UHFFFAOYSA-N 0 3 315.413 3.352 20 70 DGIDHN COc1ccc(CN[C@@H]2CCOC(C)(C)C2)c(OC(F)F)c1 ZINC000160455768 432721978 /nfs/dbraw/zinc/72/19/78/432721978.db2.gz JEUBIWBGEBDRDF-GFCCVEGCSA-N 0 3 315.360 3.344 20 70 DGIDHN C[C@H](C(=O)NCCc1cc2ccccc2o1)[C@H](N)c1ccccc1 ZINC000160487362 432722594 /nfs/dbraw/zinc/72/25/94/432722594.db2.gz ATPGHCQFVBAUDY-LIRRHRJNSA-N 0 3 322.408 3.428 20 70 DGIDHN CCN(CCN[C@H](C)c1cnn(C(C)C)c1)C(=O)OC(C)(C)C ZINC000159502140 432684748 /nfs/dbraw/zinc/68/47/48/432684748.db2.gz DUFDGEWOBGBPFH-CQSZACIVSA-N 0 3 324.469 3.372 20 70 DGIDHN c1cc2c(cc1C1(NCCOCC3CC3)CCCC1)OCCO2 ZINC000159699998 432691658 /nfs/dbraw/zinc/69/16/58/432691658.db2.gz SUPRRACHXMRUTB-UHFFFAOYSA-N 0 3 317.429 3.243 20 70 DGIDHN CC(C)C[C@H]1COCCN1CC1CCN(C(=O)C(C)(C)C)CC1 ZINC000159679242 432692034 /nfs/dbraw/zinc/69/20/34/432692034.db2.gz IVOMHEJTNSZALF-KRWDZBQOSA-N 0 3 324.509 3.018 20 70 DGIDHN CCn1cc([C@@H](C)NC[C@H](C)N(C)Cc2ccccc2)cn1 ZINC000160872805 432747765 /nfs/dbraw/zinc/74/77/65/432747765.db2.gz SJJBMQBSCBJMSA-JKSUJKDBSA-N 0 3 300.450 3.074 20 70 DGIDHN CSCC[C@@H](N)C(=O)N[C@@H](C)c1cccc(Cl)c1Cl ZINC000160988855 432752832 /nfs/dbraw/zinc/75/28/32/432752832.db2.gz FOQNPOVOGZQWEU-GZMMTYOYSA-N 0 3 321.273 3.251 20 70 DGIDHN Cc1ccsc1[C@H](Cc1ccccc1)NCC(=O)NC(C)C ZINC000160974511 432753363 /nfs/dbraw/zinc/75/33/63/432753363.db2.gz SWAVXMYIVWYOPM-INIZCTEOSA-N 0 3 316.470 3.455 20 70 DGIDHN C[C@H](c1ccccn1)N(C)CC1CCN(C(=O)C(C)(C)C)CC1 ZINC000161190270 432764885 /nfs/dbraw/zinc/76/48/85/432764885.db2.gz CDVCJKSUJLYKMW-OAHLLOKOSA-N 0 3 317.477 3.359 20 70 DGIDHN CCC(CC)n1ncc(C(=O)N[C@H](CC(C)C)CN(C)C)c1C ZINC000161173552 432764974 /nfs/dbraw/zinc/76/49/74/432764974.db2.gz XMPYQXXXYFKHSF-OAHLLOKOSA-N 0 3 322.497 3.259 20 70 DGIDHN CC(=O)Nc1cccc([C@@H](C)NC[C@H](CO)c2ccccc2)c1 ZINC000161401542 432775917 /nfs/dbraw/zinc/77/59/17/432775917.db2.gz HJFXHBACBGDXEX-RDTXWAMCSA-N 0 3 312.413 3.072 20 70 DGIDHN CC[C@@H](N[C@@H]1CCc2nc(C)nn2C1)c1ccc(Cl)s1 ZINC000160539265 432727691 /nfs/dbraw/zinc/72/76/91/432727691.db2.gz JTJDGNJTMZAYAU-GHMZBOCLSA-N 0 3 310.854 3.357 20 70 DGIDHN CC[C@@H](C)CN(CC)[C@@H](C)C(=O)NCc1ccccc1OC ZINC000160561638 432728605 /nfs/dbraw/zinc/72/86/05/432728605.db2.gz UHLWLTMVUYMBQS-CABCVRRESA-N 0 3 306.450 3.068 20 70 DGIDHN C[C@H](CC(=O)N1CCCNCC1)c1cccc(C(F)(F)F)c1 ZINC000160824076 432743599 /nfs/dbraw/zinc/74/35/99/432743599.db2.gz FGBZTGGXZSTKJG-GFCCVEGCSA-N 0 3 314.351 3.021 20 70 DGIDHN CC(C)COCCN[C@H](C)c1cnn(Cc2ccccc2)c1 ZINC000160710863 292820635 /nfs/dbraw/zinc/82/06/35/292820635.db2.gz LYIUUOAKWRSQHZ-MRXNPFEDSA-N 0 3 301.434 3.255 20 70 DGIDHN C[C@@H](CN1CCCCC1)NC(=O)[C@@H]1C[C@@H]1c1cccc(F)c1F ZINC000160363499 524604930 /nfs/dbraw/zinc/60/49/30/524604930.db2.gz RMXNDJZVROKPAK-NWANDNLSSA-N 0 3 322.399 3.059 20 70 DGIDHN CSC[C@@H](CCO)N[C@H](C)c1cccc(OC(F)F)c1 ZINC000160249634 525642977 /nfs/dbraw/zinc/64/29/77/525642977.db2.gz FVRCYCPUULOCQO-ZYHUDNBSSA-N 0 3 305.390 3.053 20 70 DGIDHN CC(C)(C)OC(=O)N(CCNCc1ccc(F)cc1)C1CC1 ZINC000218190435 627104519 /nfs/dbraw/zinc/10/45/19/627104519.db2.gz TWQKLSJSYDWOGG-UHFFFAOYSA-N 0 3 308.397 3.315 20 70 DGIDHN CC(C)(C)OC(=O)N(CCNCc1cccc(F)c1)C1CC1 ZINC000218190907 627104575 /nfs/dbraw/zinc/10/45/75/627104575.db2.gz XHXKRZQKVVAYDZ-UHFFFAOYSA-N 0 3 308.397 3.315 20 70 DGIDHN Cc1nc2n(n1)C[C@@H](N[C@@H](C)c1ccccc1C(F)(F)F)CC2 ZINC000160450695 282117227 /nfs/dbraw/zinc/11/72/27/282117227.db2.gz CLNAPXGFKQWBEB-JQWIXIFHSA-N 0 3 324.350 3.271 20 70 DGIDHN Cc1nc2n(n1)C[C@H](N[C@H](C)c1sc(C(C)C)nc1C)CC2 ZINC000160358011 282127510 /nfs/dbraw/zinc/12/75/10/282127510.db2.gz UCDLZPAOWDZVIP-ZWNOBZJWSA-N 0 3 319.478 3.140 20 70 DGIDHN CC(C)OCCCN1CCC(NC(=O)Nc2ccccc2)CC1 ZINC000159567662 186127574 /nfs/dbraw/zinc/12/75/74/186127574.db2.gz CISMWSCUTFSBMD-UHFFFAOYSA-N 0 3 319.449 3.088 20 70 DGIDHN CN(Cc1cccc(OCC(F)(F)F)c1)C[C@@H]1CCC[C@@H]1O ZINC000159584223 186128760 /nfs/dbraw/zinc/12/87/60/186128760.db2.gz WYXWBGIGDUWXMT-ZFWWWQNUSA-N 0 3 317.351 3.221 20 70 DGIDHN Cc1ccccc1[C@@H](C)NCCNC(=O)c1c(F)cccc1F ZINC000159609023 186130906 /nfs/dbraw/zinc/13/09/06/186130906.db2.gz VNTAEVQMRPKCJG-CYBMUJFWSA-N 0 3 318.367 3.354 20 70 DGIDHN NC1(C(=O)N2CC[C@H](c3ccc(Cl)cc3)C2)CCCCC1 ZINC000159813340 197366663 /nfs/dbraw/zinc/36/66/63/197366663.db2.gz SAVBCYPTRNCVOM-AWEZNQCLSA-N 0 3 306.837 3.318 20 70 DGIDHN CCc1ccc([C@@H](C)CC(=O)NC[C@@H]2CCCN(C)C2)cc1 ZINC000159513975 400730101 /nfs/dbraw/zinc/73/01/01/400730101.db2.gz DOKJMLONLHGYJG-RDJZCZTQSA-N 0 3 302.462 3.201 20 70 DGIDHN COc1ccc(Cl)cc1CNC(=O)[C@H](C)N1CCCCCC1 ZINC000217193802 165376445 /nfs/dbraw/zinc/37/64/45/165376445.db2.gz WUDJXLCBXLERAI-ZDUSSCGKSA-N 0 3 324.852 3.229 20 70 DGIDHN COc1ccccc1CN1CCCN(Cc2ccccc2)CC1 ZINC000218017289 165378041 /nfs/dbraw/zinc/37/80/41/165378041.db2.gz UUKBKAWHIOHDMQ-UHFFFAOYSA-N 0 3 310.441 3.403 20 70 DGIDHN CC(C)N(C(=O)CN1CCc2ccccc2CC1)C1CCCC1 ZINC000217223101 432655422 /nfs/dbraw/zinc/65/54/22/432655422.db2.gz ZBPUVGUNGGQIEP-UHFFFAOYSA-N 0 3 314.473 3.267 20 70 DGIDHN CN(Cc1ccc(C(=O)OC(C)(C)C)cc1)C[C@H]1CCC[C@@H]1O ZINC000159778367 432696576 /nfs/dbraw/zinc/69/65/76/432696576.db2.gz ONRCTRCZAFNIKR-SJORKVTESA-N 0 3 319.445 3.235 20 70 DGIDHN CN(Cc1cc(F)cc(Br)c1)C[C@@H]1CCC[C@@H]1O ZINC000159866889 432699859 /nfs/dbraw/zinc/69/98/59/432699859.db2.gz BPMHILPZBAFRCI-FZMZJTMJSA-N 0 3 316.214 3.181 20 70 DGIDHN CC(C)N(C(=O)N[C@H]1C[C@H](C)N(Cc2ccccc2)C1)C1CC1 ZINC000160139283 432708842 /nfs/dbraw/zinc/70/88/42/432708842.db2.gz KVEDNBZZQPOXLN-RDJZCZTQSA-N 0 3 315.461 3.232 20 70 DGIDHN CC[C@H](N[C@H]1CCc2nc(C)nn2C1)c1ccc(Cl)s1 ZINC000160539408 432726410 /nfs/dbraw/zinc/72/64/10/432726410.db2.gz JTJDGNJTMZAYAU-QWRGUYRKSA-N 0 3 310.854 3.357 20 70 DGIDHN CC[C@H](N[C@@H](CCO)CSC)c1ccccc1OC(F)F ZINC000160329197 432715764 /nfs/dbraw/zinc/71/57/64/432715764.db2.gz QABFRJVCYVDKEG-AAEUAGOBSA-N 0 3 319.417 3.443 20 70 DGIDHN COCCN(Cc1c[nH]nc1-c1cccnc1)Cc1ccccc1 ZINC000160450452 432720971 /nfs/dbraw/zinc/72/09/71/432720971.db2.gz RVXAICLPBDRZPZ-UHFFFAOYSA-N 0 3 322.412 3.120 20 70 DGIDHN Cc1nc2n(n1)C[C@H](N[C@@H](C)c1ccc(OC(C)C)cc1)CC2 ZINC000160491189 432723644 /nfs/dbraw/zinc/72/36/44/432723644.db2.gz GQJXJOTVXKUANO-XJKSGUPXSA-N 0 3 314.433 3.039 20 70 DGIDHN CCCn1c(CN[C@H]2CCOC(C)(C)C2)nc2ccccc21 ZINC000160522727 432724072 /nfs/dbraw/zinc/72/40/72/432724072.db2.gz IMEWOGKRKGGSMA-AWEZNQCLSA-N 0 3 301.434 3.494 20 70 DGIDHN CCN(Cc1cccc2c[nH]nc21)C[C@H]1COc2ccccc2O1 ZINC000160951834 432751327 /nfs/dbraw/zinc/75/13/27/432751327.db2.gz LYQGVDIDDRAKLW-INIZCTEOSA-N 0 3 323.396 3.225 20 70 DGIDHN C[C@@H](N[C@H](CCO)c1ccccc1)c1ccc(-n2cncn2)cc1 ZINC000161096102 432759954 /nfs/dbraw/zinc/75/99/54/432759954.db2.gz WVVUCKDMQSVDGX-DNVCBOLYSA-N 0 3 322.412 3.042 20 70 DGIDHN CCCN(CCO)Cc1cn(-c2ccccc2)nc1C(C)C ZINC000161192927 432764684 /nfs/dbraw/zinc/76/46/84/432764684.db2.gz WEPYHALRLNNCGX-UHFFFAOYSA-N 0 3 301.434 3.200 20 70 DGIDHN CCCCOc1ncccc1CNC1CCC2(CC1)OCCO2 ZINC000161375021 432776153 /nfs/dbraw/zinc/77/61/53/432776153.db2.gz UYWZTDSBJSNJLZ-UHFFFAOYSA-N 0 3 320.433 3.036 20 70 DGIDHN CC[C@H](N[C@@H]1CCc2nc(C)nn2C1)c1ccc(Cl)s1 ZINC000160539140 432727429 /nfs/dbraw/zinc/72/74/29/432727429.db2.gz JTJDGNJTMZAYAU-MNOVXSKESA-N 0 3 310.854 3.357 20 70 DGIDHN CCO[C@@H]1C[C@@H](N(C)Cc2c(C)nc3ccccn32)C1(C)C ZINC000160570545 432728261 /nfs/dbraw/zinc/72/82/61/432728261.db2.gz LTWWPPFESDDMBT-HZPDHXFCSA-N 0 3 301.434 3.278 20 70 DGIDHN CC(C)C[C@H](NCC(=O)NCC(F)(F)F)c1cccs1 ZINC000160588372 432730190 /nfs/dbraw/zinc/73/01/90/432730190.db2.gz JQOVENHTJWZMOK-JTQLQIEISA-N 0 3 308.369 3.103 20 70 DGIDHN Cc1ccc(C)c([C@@H]2CCCN2C(=O)C2CCN(C)CC2)c1 ZINC000160665335 432733401 /nfs/dbraw/zinc/73/34/01/432733401.db2.gz JCKZZDXIAKTFRJ-SFHVURJKSA-N 0 3 300.446 3.309 20 70 DGIDHN CCCCN(CC1CCCCCC1)[C@H]1CCS(=O)(=O)C1 ZINC000160787625 432740947 /nfs/dbraw/zinc/74/09/47/432740947.db2.gz XUOUNKXYMZJEQJ-INIZCTEOSA-N 0 3 301.496 3.246 20 70 DGIDHN CC[C@]1(C)C[C@@H]1C(=O)N(Cc1ccco1)C1CCN(C)CC1 ZINC000160849216 432745228 /nfs/dbraw/zinc/74/52/28/432745228.db2.gz JZWXRUZAEPVDMV-SJLPKXTDSA-N 0 3 304.434 3.139 20 70 DGIDHN C[C@H](CSC(C)(C)C)N[C@H](C)C(=O)NCc1ccccc1 ZINC000161194331 289724695 /nfs/dbraw/zinc/72/46/95/289724695.db2.gz WZPAXYQFZFLYER-ZIAGYGMSSA-N 0 3 308.491 3.201 20 70 DGIDHN CCC[C@@H](NC[C@H](O)CN(C)C)c1ccc(Cl)cc1Cl ZINC000159430929 292792502 /nfs/dbraw/zinc/79/25/02/292792502.db2.gz ZIGMKHMSHVVIHZ-SWLSCSKDSA-N 0 3 319.276 3.347 20 70 DGIDHN C[C@@H]1CC[C@H](C)N1C(=O)NC[C@@H](c1ccccc1)N1CCCC1 ZINC000161398717 292834427 /nfs/dbraw/zinc/83/44/27/292834427.db2.gz RBYGVIYVOVJCLE-JZXOWHBKSA-N 0 3 315.461 3.406 20 70 DGIDHN C[C@H](C(=O)N[C@H]1CCOC2(CCCCC2)C1)N1CCCCCC1 ZINC000160729790 298191004 /nfs/dbraw/zinc/19/10/04/298191004.db2.gz DXEFOPLWCYSZBN-SJORKVTESA-N 0 3 322.493 3.249 20 70 DGIDHN Cc1ncc([C@H](C)NC[C@@H](C)N2CCc3ccccc3C2)c(C)n1 ZINC000159805258 302703599 /nfs/dbraw/zinc/70/35/99/302703599.db2.gz QYDYHAIRVUPTJB-CABCVRRESA-N 0 3 324.472 3.191 20 70 DGIDHN CCN1CCCN(C(=O)NCC(C)(C)c2ccc(C)cc2)CC1 ZINC000159816475 529023704 /nfs/dbraw/zinc/02/37/04/529023704.db2.gz UOHIZKNXPPCCQI-UHFFFAOYSA-N 0 3 317.477 3.010 20 70 DGIDHN Cc1nccc(NC(=O)NCC(C)(C)N2CCCCC2)c1Cl ZINC000159788557 546056607 /nfs/dbraw/zinc/05/66/07/546056607.db2.gz LALBLYURAUMEDC-UHFFFAOYSA-N 0 3 324.856 3.429 20 70 DGIDHN CCc1ccc(CN(CCCCS(C)(=O)=O)C2CC2)cc1 ZINC000161438451 546069582 /nfs/dbraw/zinc/06/95/82/546069582.db2.gz NOVWYUNJJSCUNZ-UHFFFAOYSA-N 0 3 309.475 3.038 20 70 DGIDHN CC(C)CNC(=O)[C@H](C)NCC1(c2ccccc2)CCCC1 ZINC000217578115 575908904 /nfs/dbraw/zinc/90/89/04/575908904.db2.gz KIWKJQIFXFAXIV-INIZCTEOSA-N 0 3 302.462 3.249 20 70 DGIDHN Cc1ncc([C@H](C)NC[C@@H](C)N(C)Cc2ccccc2)c(C)n1 ZINC000160862589 282165543 /nfs/dbraw/zinc/16/55/43/282165543.db2.gz XTBUQTUNRUVXAK-CABCVRRESA-N 0 3 312.461 3.265 20 70 DGIDHN C[C@H](N[C@@H]1CCCSC1)c1cnn(Cc2ccccc2)c1 ZINC000159624042 186131365 /nfs/dbraw/zinc/13/13/65/186131365.db2.gz FIRHHTLJDPRPBC-WMLDXEAASA-N 0 3 301.459 3.478 20 70 DGIDHN N[C@@H](Cc1ccccc1)C(=O)N[C@@H]1CCC[C@H]1c1ccccc1 ZINC000159716292 186137413 /nfs/dbraw/zinc/13/74/13/186137413.db2.gz MKZDECCDSRMEJD-GBESFXJTSA-N 0 3 308.425 3.009 20 70 DGIDHN NC(=O)CC1CCN(Cc2ccccc2OC2CCCC2)CC1 ZINC000159730829 186138113 /nfs/dbraw/zinc/13/81/13/186138113.db2.gz UDWKXZSWFJQIEX-UHFFFAOYSA-N 0 3 316.445 3.095 20 70 DGIDHN CC[C@@H](NC[C@H](CC)Oc1ccccc1F)c1cnn(C)c1 ZINC000160304499 197399059 /nfs/dbraw/zinc/39/90/59/197399059.db2.gz INMHJHSZIRWTEE-GOEBONIOSA-N 0 3 305.397 3.458 20 70 DGIDHN CC[C@H](CN[C@H](CC)c1cnn(C)c1)Oc1ccccc1F ZINC000160304614 197399142 /nfs/dbraw/zinc/39/91/42/197399142.db2.gz INMHJHSZIRWTEE-GDBMZVCRSA-N 0 3 305.397 3.458 20 70 DGIDHN COc1ccc2c(c1)[C@@H](NC[C@@](C)(O)c1ccsc1)CC2 ZINC000159945144 197376105 /nfs/dbraw/zinc/37/61/05/197376105.db2.gz URRUQPIJMMNQQC-DLBZAZTESA-N 0 3 303.427 3.241 20 70 DGIDHN CCN(CC)[C@@H](CNCc1ccnn1CC)c1ccccc1 ZINC000159873478 197369655 /nfs/dbraw/zinc/36/96/55/197369655.db2.gz RGPGLHJLAZGUDR-SFHVURJKSA-N 0 3 300.450 3.076 20 70 DGIDHN CCn1cc([C@@H](C)NC[C@@H](C)N2CCc3sccc3C2)cn1 ZINC000159865080 197369685 /nfs/dbraw/zinc/36/96/85/197369685.db2.gz KZWSBMPEOPJHQY-ZIAGYGMSSA-N 0 3 318.490 3.062 20 70 DGIDHN Fc1cc(F)cc(CNC[C@@H](c2ccco2)N2CCCC2)c1 ZINC000159569853 228242350 /nfs/dbraw/zinc/24/23/50/228242350.db2.gz XRRNJYCNHGRJNV-INIZCTEOSA-N 0 3 306.356 3.485 20 70 DGIDHN CCN1CCCN(C(=O)N[C@H]2CCc3c2cccc3Cl)CC1 ZINC000159746131 276162290 /nfs/dbraw/zinc/16/22/90/276162290.db2.gz SDHXMRXYWKNYHG-INIZCTEOSA-N 0 3 321.852 3.065 20 70 DGIDHN CN(C)Cc1cccc(CNC(=O)c2c(F)cc(F)cc2F)c1 ZINC000159713305 432693419 /nfs/dbraw/zinc/69/34/19/432693419.db2.gz ANPNOOJVJKHATH-UHFFFAOYSA-N 0 3 322.330 3.096 20 70 DGIDHN CCN1CCCN(C(=O)NCc2ccc3ccccc3c2)CC1 ZINC000159823673 432697755 /nfs/dbraw/zinc/69/77/55/432697755.db2.gz ZVXANGBDIZMOSQ-UHFFFAOYSA-N 0 3 311.429 3.077 20 70 DGIDHN CC(C)N(C(=O)N[C@@H]1C[C@@H](C)N(Cc2ccccc2)C1)C1CC1 ZINC000160139414 432708742 /nfs/dbraw/zinc/70/87/42/432708742.db2.gz KVEDNBZZQPOXLN-NVXWUHKLSA-N 0 3 315.461 3.232 20 70 DGIDHN Cc1ccoc1CNc1ccc(OC2CCN(C)CC2)nc1 ZINC000160164561 432709191 /nfs/dbraw/zinc/70/91/91/432709191.db2.gz QPFZLLWBEKAZIM-UHFFFAOYSA-N 0 3 301.390 3.068 20 70 DGIDHN COc1ccc([C@@H](C)N[C@@H](CCO)CSC)cc1Cl ZINC000160225018 432711630 /nfs/dbraw/zinc/71/16/30/432711630.db2.gz HFXQKDRTFMGVIF-PWSUYJOCSA-N 0 3 303.855 3.113 20 70 DGIDHN CC(C)N(CC(=O)Nc1cc(C(C)(C)C)nn1C)C1CCCC1 ZINC000160322969 432713655 /nfs/dbraw/zinc/71/36/55/432713655.db2.gz BHUGDHNMEPWLJL-UHFFFAOYSA-N 0 3 320.481 3.309 20 70 DGIDHN Cc1ccc(C(=O)CCN2CC[C@@H](Oc3ccncc3)C2)cc1 ZINC000160330041 432715000 /nfs/dbraw/zinc/71/50/00/432715000.db2.gz UGRAJAQZMAAGKC-GOSISDBHSA-N 0 3 310.397 3.116 20 70 DGIDHN CCCCN(C)C(=O)N[C@H]1C[C@@H](C)N(Cc2ccccc2)C1 ZINC000160342878 432715133 /nfs/dbraw/zinc/71/51/33/432715133.db2.gz MUHORULTGZTZNP-WBVHZDCISA-N 0 3 303.450 3.091 20 70 DGIDHN CCN1CCC[C@H]1CNC(=O)[C@@H](C)Cc1ccc(Cl)cc1 ZINC000160329522 432715711 /nfs/dbraw/zinc/71/57/11/432715711.db2.gz XOYDGUPEOXSKOA-BBRMVZONSA-N 0 3 308.853 3.119 20 70 DGIDHN CCN1CCC[C@@H]1CNC(=O)[C@@H](C)Cc1ccc(Cl)cc1 ZINC000160329369 432716044 /nfs/dbraw/zinc/71/60/44/432716044.db2.gz XOYDGUPEOXSKOA-XJKSGUPXSA-N 0 3 308.853 3.119 20 70 DGIDHN Cc1nc2n(n1)C[C@H](N[C@@H](C)c1cccc(C(F)(F)F)c1)CC2 ZINC000160483562 432722959 /nfs/dbraw/zinc/72/29/59/432722959.db2.gz WTDDDWKAANNNNB-IINYFYTJSA-N 0 3 324.350 3.271 20 70 DGIDHN COCCN(C)CCN[C@@H](C)c1nc(-c2ccccc2)cs1 ZINC000159411143 432682186 /nfs/dbraw/zinc/68/21/86/432682186.db2.gz NLQKJWAMNIGSTE-AWEZNQCLSA-N 0 3 319.474 3.039 20 70 DGIDHN CC[C@H](CC(=O)NC[C@H]1CCCN(C)C1)c1ccc(C)cc1 ZINC000159509995 432685813 /nfs/dbraw/zinc/68/58/13/432685813.db2.gz OUIHZBIOBNZLIE-IAGOWNOFSA-N 0 3 302.462 3.337 20 70 DGIDHN CS[C@H](C)CC(=O)NC1CCN(Cc2cccc(C)c2)CC1 ZINC000159598886 432689011 /nfs/dbraw/zinc/68/90/11/432689011.db2.gz HMRMHJFRLLWGKT-OAHLLOKOSA-N 0 3 320.502 3.217 20 70 DGIDHN CC[C@H](NCC1CCN(C(C)=O)CC1)c1ccc(F)cc1F ZINC000160890994 432747868 /nfs/dbraw/zinc/74/78/68/432747868.db2.gz KXXTYENHWYRWPK-KRWDZBQOSA-N 0 3 310.388 3.264 20 70 DGIDHN CCn1cc([C@@H](C)NC[C@@H](C)N(C)Cc2ccccc2)cn1 ZINC000160872547 432748355 /nfs/dbraw/zinc/74/83/55/432748355.db2.gz SJJBMQBSCBJMSA-HZPDHXFCSA-N 0 3 300.450 3.074 20 70 DGIDHN C[C@@H](NCc1ccccc1CS(C)(=O)=O)c1cccs1 ZINC000160933741 432749282 /nfs/dbraw/zinc/74/92/82/432749282.db2.gz KFMZZEVDSKSIFV-GFCCVEGCSA-N 0 3 309.456 3.144 20 70 DGIDHN COc1ccc([C@@H](CCC(C)C)NCC(=O)NC(C)C)cc1 ZINC000160914468 432750318 /nfs/dbraw/zinc/75/03/18/432750318.db2.gz JTOKWIJHZNADQK-QGZVFWFLSA-N 0 3 306.450 3.287 20 70 DGIDHN CN(C)Cc1ccc(C(=O)Nc2cnn(-c3ccccc3)c2)cc1 ZINC000161310938 432773114 /nfs/dbraw/zinc/77/31/14/432773114.db2.gz TUOQZOVWNCPDMH-UHFFFAOYSA-N 0 3 320.396 3.186 20 70 DGIDHN CC(=O)NC1CCC(NCc2ccccc2OCC(C)C)CC1 ZINC000161338802 432773614 /nfs/dbraw/zinc/77/36/14/432773614.db2.gz MZRPJRAVORLZFO-UHFFFAOYSA-N 0 3 318.461 3.258 20 70 DGIDHN CSCC[C@H](N)C(=O)Nc1ccc(OCCC(C)C)cc1 ZINC000161383042 432777051 /nfs/dbraw/zinc/77/70/51/432777051.db2.gz KSIJMNMHCZSRMK-HNNXBMFYSA-N 0 3 310.463 3.130 20 70 DGIDHN CC[C@H](C)CN(CC)[C@@H](C)C(=O)Nc1cc(OC)ccc1OC ZINC000160544047 432726838 /nfs/dbraw/zinc/72/68/38/432726838.db2.gz CIRVDERNFCOOPC-KBPBESRZSA-N 0 3 322.449 3.399 20 70 DGIDHN CC[C@@H](C)CN(CC)[C@@H](C)C(=O)Nc1cccc(NC(C)=O)c1 ZINC000160529361 432727264 /nfs/dbraw/zinc/72/72/64/432727264.db2.gz OSLRNKFYMRWVRJ-KGLIPLIRSA-N 0 3 319.449 3.340 20 70 DGIDHN CC[C@H](C)CN(CC)[C@@H](C)C(=O)N[C@@H]1CCOc2ccccc21 ZINC000160563666 432728415 /nfs/dbraw/zinc/72/84/15/432728415.db2.gz BWDGWOJCZWHUJG-YQQAZPJKSA-N 0 3 318.461 3.383 20 70 DGIDHN C[C@@H](C(=O)N[C@@H]1CCOC2(CCCCC2)C1)N1CCCCCC1 ZINC000160729407 432737521 /nfs/dbraw/zinc/73/75/21/432737521.db2.gz DXEFOPLWCYSZBN-DLBZAZTESA-N 0 3 322.493 3.249 20 70 DGIDHN CCc1ccc([C@H](CO)NCC2=Cc3ccccc3OC2)cc1 ZINC000160786525 432740228 /nfs/dbraw/zinc/74/02/28/432740228.db2.gz HZMAPJWSZLYWBS-IBGZPJMESA-N 0 3 309.409 3.348 20 70 DGIDHN C[C@H]1C[C@@H](NC(=O)NCc2ccccc2)CN1Cc1ccccc1 ZINC000161502947 432783026 /nfs/dbraw/zinc/78/30/26/432783026.db2.gz XGBBYQAEBRXFHP-QFBILLFUSA-N 0 3 323.440 3.149 20 70 DGIDHN C[C@H]1C[C@H](NC(=O)NCc2ccccc2)CN1Cc1ccccc1 ZINC000161502718 432783803 /nfs/dbraw/zinc/78/38/03/432783803.db2.gz XGBBYQAEBRXFHP-LPHOPBHVSA-N 0 3 323.440 3.149 20 70 DGIDHN Cc1ccccc1[C@@H](C)N[C@@H](C)C(=O)NCCc1ccccc1 ZINC000159418839 292792442 /nfs/dbraw/zinc/79/24/42/292792442.db2.gz OXPUMWQFWCJERZ-SJORKVTESA-N 0 3 310.441 3.393 20 70 DGIDHN Cc1cc(CNC(=O)N(CCN(C)C)C2CCCC2)ccc1F ZINC000159597523 292796312 /nfs/dbraw/zinc/79/63/12/292796312.db2.gz DISDUFSFSSNNOJ-UHFFFAOYSA-N 0 3 321.440 3.150 20 70 DGIDHN C[C@@H](NCC(=O)NCc1ccccc1)C(C)(C)c1ccccc1 ZINC000160073288 292807004 /nfs/dbraw/zinc/80/70/04/292807004.db2.gz QQTQMPOMPWNIIH-MRXNPFEDSA-N 0 3 310.441 3.259 20 70 DGIDHN C/C=C/COc1ccc(CC[C@H](C)NCC(=O)NC(C)C)cc1 ZINC000160946374 292824807 /nfs/dbraw/zinc/82/48/07/292824807.db2.gz UAZGBBZSJGTPSN-JFDDCEBESA-N 0 3 318.461 3.077 20 70 DGIDHN CSC[C@H](CCO)N[C@H]1CCCOc2c(Cl)cccc21 ZINC000160205900 295623482 /nfs/dbraw/zinc/62/34/82/295623482.db2.gz KOPOPGXNOXMFMR-FZMZJTMJSA-N 0 3 315.866 3.257 20 70 DGIDHN O=C(NCCN1CCCCCC1)[C@@H]1C[C@@H]1c1cc(F)ccc1F ZINC000160221370 526309487 /nfs/dbraw/zinc/30/94/87/526309487.db2.gz UQLOKILOWNWIIS-GDBMZVCRSA-N 0 3 322.399 3.061 20 70 DGIDHN CCOCCC1(C(=O)NC[C@@H](c2ccccc2)N(C)C)CCC1 ZINC000160645209 528605326 /nfs/dbraw/zinc/60/53/26/528605326.db2.gz CGJQNARBLNBZNU-KRWDZBQOSA-N 0 3 318.461 3.002 20 70 DGIDHN CCN1CCCN(C(=O)NCC(C)(C)c2cccc(C)c2)CC1 ZINC000159778052 529023023 /nfs/dbraw/zinc/02/30/23/529023023.db2.gz KEHPCFYIVKNQGK-UHFFFAOYSA-N 0 3 317.477 3.010 20 70 DGIDHN CCN1CCCN(C(=O)N[C@H](C)c2cc(C)cc(C)c2)CC1 ZINC000159832415 529031215 /nfs/dbraw/zinc/03/12/15/529031215.db2.gz UNJGEEAOZYGOKE-MRXNPFEDSA-N 0 3 303.450 3.102 20 70 DGIDHN CCOc1cc2c(cc1CN[C@H]1CCOC(C)(C)C1)O[C@H](C)C2 ZINC000160535265 546060668 /nfs/dbraw/zinc/06/06/68/546060668.db2.gz LYUJXKYJZQEUGQ-CJNGLKHVSA-N 0 3 319.445 3.456 20 70 DGIDHN CC[C@H](NC[C@H]1CN(CC(C)C)CCO1)c1ccc(C)cc1 ZINC000216642090 546262989 /nfs/dbraw/zinc/26/29/89/546262989.db2.gz BMVKDADCRIFLKB-OALUTQOASA-N 0 3 304.478 3.393 20 70 DGIDHN C[C@@H](NC(C)(C)CNC(=O)NC1(C)CCC1)c1ccccc1 ZINC000161217192 292831645 /nfs/dbraw/zinc/83/16/45/292831645.db2.gz UGFAOPUTHUWVLF-CQSZACIVSA-N 0 3 303.450 3.358 20 70 DGIDHN N[C@H](Cc1ccccc1)C(=O)N[C@H]1CCC[C@@H]1c1ccccc1 ZINC000159718541 186137615 /nfs/dbraw/zinc/13/76/15/186137615.db2.gz MKZDECCDSRMEJD-QRVBRYPASA-N 0 3 308.425 3.009 20 70 DGIDHN Cc1ccsc1[C@@H](Cc1ccccc1)NCC(=O)NC(C)C ZINC000160974377 197453398 /nfs/dbraw/zinc/45/33/98/197453398.db2.gz SWAVXMYIVWYOPM-MRXNPFEDSA-N 0 3 316.470 3.455 20 70 DGIDHN COc1ccc(CNC(=O)CN[C@@H](C)c2ccc(C)s2)cc1 ZINC000160956660 197452895 /nfs/dbraw/zinc/45/28/95/197452895.db2.gz WSGHJORCMALDBH-ZDUSSCGKSA-N 0 3 318.442 3.032 20 70 DGIDHN CCN(C(=O)N[C@H]1C[C@@H](C)N(Cc2ccccc2)C1)C(C)C ZINC000160313451 197399798 /nfs/dbraw/zinc/39/97/98/197399798.db2.gz XRRPMBSXTXDKRN-WBVHZDCISA-N 0 3 303.450 3.089 20 70 DGIDHN C[C@@H]1CN(Cc2ccccc2)C[C@@H]1Nc1nnc(C2CC2)s1 ZINC000160225757 197394084 /nfs/dbraw/zinc/39/40/84/197394084.db2.gz HNBVINNDHMJYQY-DOMZBBRYSA-N 0 3 314.458 3.348 20 70 DGIDHN CCN(C)CCNC(=O)C[C@H](C)c1cccc(C(F)(F)F)c1 ZINC000160145404 197389172 /nfs/dbraw/zinc/38/91/72/197389172.db2.gz RQUPKHYNVOREAL-LBPRGKRZSA-N 0 3 316.367 3.267 20 70 DGIDHN CCN1CCCN(C(=O)NCc2cccc3ccccc32)CC1 ZINC000159778505 197363722 /nfs/dbraw/zinc/36/37/22/197363722.db2.gz PURMEROLZJIGKU-UHFFFAOYSA-N 0 3 311.429 3.077 20 70 DGIDHN CCN1CCCN(C(=O)N[C@H](C)c2ccccc2Cl)CC1 ZINC000159529240 197360666 /nfs/dbraw/zinc/36/06/66/197360666.db2.gz DIOCJFITVMKIAJ-CYBMUJFWSA-N 0 3 309.841 3.138 20 70 DGIDHN CCN(CCN[C@H](C)c1cnc(C)nc1C)C(=O)OC(C)(C)C ZINC000159458181 197355377 /nfs/dbraw/zinc/35/53/77/197355377.db2.gz MGGRPCFJSUEEMJ-GFCCVEGCSA-N 0 3 322.453 3.001 20 70 DGIDHN O=C1CCCN1CCCN[C@H]1CC2(CCC2)Oc2ccccc21 ZINC000159540372 296318469 /nfs/dbraw/zinc/31/84/69/296318469.db2.gz ILEVOFTVUJDJQR-INIZCTEOSA-N 0 3 314.429 3.035 20 70 DGIDHN CCc1ccc([C@@H](C)CC(=O)NC[C@H]2CCCN(C)C2)cc1 ZINC000159514245 400729988 /nfs/dbraw/zinc/72/99/88/400729988.db2.gz DOKJMLONLHGYJG-DOTOQJQBSA-N 0 3 302.462 3.201 20 70 DGIDHN CCc1ccc([C@@H](C)CC(=O)N[C@@H]2CCN(CC3CC3)C2)cc1 ZINC000159494917 400730264 /nfs/dbraw/zinc/73/02/64/400730264.db2.gz CWAUEFQNWPPWPZ-HNAYVOBHSA-N 0 3 314.473 3.343 20 70 DGIDHN CC[C@H](NCCN1C(=O)Cc2ccccc21)c1ccc(F)cc1 ZINC000160861590 400736698 /nfs/dbraw/zinc/73/66/98/400736698.db2.gz CZTGTZXNOTUHHE-KRWDZBQOSA-N 0 3 312.388 3.456 20 70 DGIDHN CCN(Cc1ccc(OC)cc1)C[C@H]1COc2ccccc2O1 ZINC000217391261 165378396 /nfs/dbraw/zinc/37/83/96/165378396.db2.gz CHQGRJDRMDWICJ-KRWDZBQOSA-N 0 3 313.397 3.357 20 70 DGIDHN CC[C@H](C(=O)N[C@H]1CCSc2ccc(Cl)cc21)N(C)C ZINC000160095289 273741257 /nfs/dbraw/zinc/74/12/57/273741257.db2.gz CEQGTFODYHJXMB-QWHCGFSZSA-N 0 3 312.866 3.333 20 70 DGIDHN CSc1ccc([C@H](C)N[C@H]2CCc3nc(C)nn3C2)cc1F ZINC000160404978 274188588 /nfs/dbraw/zinc/18/85/88/274188588.db2.gz UXWSDUUHNKRNSI-GWCFXTLKSA-N 0 3 320.437 3.113 20 70 DGIDHN CCN1CCCN(C(=O)N[C@@H]2CCc3c2cccc3Cl)CC1 ZINC000159745996 276161902 /nfs/dbraw/zinc/16/19/02/276161902.db2.gz SDHXMRXYWKNYHG-MRXNPFEDSA-N 0 3 321.852 3.065 20 70 DGIDHN COC(=O)c1cccc(CN(C)Cc2cccc(N(C)C)c2)c1 ZINC000159828833 432697977 /nfs/dbraw/zinc/69/79/77/432697977.db2.gz RLFQSGMWMFZDKL-UHFFFAOYSA-N 0 3 312.413 3.171 20 70 DGIDHN CN(C)c1cccc(CN(C)CCC(=O)Nc2ccccc2)c1 ZINC000159806655 432698196 /nfs/dbraw/zinc/69/81/96/432698196.db2.gz TVWIKJWWCMESLA-UHFFFAOYSA-N 0 3 311.429 3.213 20 70 DGIDHN C[C@@H](NC[C@H](C)N1CCc2ccccc2C1)c1cncs1 ZINC000159804688 432698208 /nfs/dbraw/zinc/69/82/08/432698208.db2.gz DHBPUWCGTSURGE-UONOGXRCSA-N 0 3 301.459 3.241 20 70 DGIDHN CC[C@H](NCCS(=O)(=O)c1ccc(F)cc1)c1ccccc1 ZINC000160549764 432726481 /nfs/dbraw/zinc/72/64/81/432726481.db2.gz DHWFLJDIZGDEQD-KRWDZBQOSA-N 0 3 321.417 3.340 20 70 DGIDHN CCN1CCC[C@@H]1CNC(=O)[C@@H](C)Cc1cccc(Cl)c1 ZINC000160329671 432715615 /nfs/dbraw/zinc/71/56/15/432715615.db2.gz HSQNYKNOJCYQCD-XJKSGUPXSA-N 0 3 308.853 3.119 20 70 DGIDHN COc1ccc(CN[C@H]2CCOC(C)(C)C2)c(OC(F)F)c1 ZINC000160455906 432720468 /nfs/dbraw/zinc/72/04/68/432720468.db2.gz JEUBIWBGEBDRDF-LBPRGKRZSA-N 0 3 315.360 3.344 20 70 DGIDHN CN(CCCNC(=O)N1CCC2(CCC2)C1)Cc1ccccc1 ZINC000159368617 432681961 /nfs/dbraw/zinc/68/19/61/432681961.db2.gz GETSFLKBZUDFJW-UHFFFAOYSA-N 0 3 315.461 3.094 20 70 DGIDHN CCC[C@@H](NC[C@H](O)COC)c1ccc(Cl)cc1Cl ZINC000159578856 432689124 /nfs/dbraw/zinc/68/91/24/432689124.db2.gz GDSZWPCFGBBVOB-SMDDNHRTSA-N 0 3 306.233 3.432 20 70 DGIDHN COc1ccc([C@H](CCC(C)C)NCC(=O)NC(C)C)cc1 ZINC000160914370 432750123 /nfs/dbraw/zinc/75/01/23/432750123.db2.gz JTOKWIJHZNADQK-KRWDZBQOSA-N 0 3 306.450 3.287 20 70 DGIDHN CCN(Cc1cccc2c[nH]nc21)C[C@@H]1COc2ccccc2O1 ZINC000160951703 432750631 /nfs/dbraw/zinc/75/06/31/432750631.db2.gz LYQGVDIDDRAKLW-MRXNPFEDSA-N 0 3 323.396 3.225 20 70 DGIDHN CC[C@H](NCC(=O)NCc1ccc(OC)cc1)c1cccs1 ZINC000160978724 432752937 /nfs/dbraw/zinc/75/29/37/432752937.db2.gz RVMLWWOUEBUDCI-HNNXBMFYSA-N 0 3 318.442 3.114 20 70 DGIDHN CSCC[C@@H](N)C(=O)N[C@H](C)c1cccc(Cl)c1Cl ZINC000160988940 432753138 /nfs/dbraw/zinc/75/31/38/432753138.db2.gz FOQNPOVOGZQWEU-LDYMZIIASA-N 0 3 321.273 3.251 20 70 DGIDHN CC(C)[C@@H](N[C@@H](C)c1cnn(C)c1)c1ccc2c(c1)OCCO2 ZINC000161026183 432754248 /nfs/dbraw/zinc/75/42/48/432754248.db2.gz ORAXSPVZXULNEH-SCLBCKFNSA-N 0 3 315.417 3.239 20 70 DGIDHN Cc1cnc(CCN(C)CCN(C)Cc2ccc(F)cc2)s1 ZINC000161026307 432754610 /nfs/dbraw/zinc/75/46/10/432754610.db2.gz NXVWJRDOVYVLDU-UHFFFAOYSA-N 0 3 321.465 3.197 20 70 DGIDHN C[C@@H](CC1CCOCC1)NCC(=O)Nc1ccc(Cl)cc1 ZINC000161117814 432761850 /nfs/dbraw/zinc/76/18/50/432761850.db2.gz UGQIYCIVQAGNRI-LBPRGKRZSA-N 0 3 310.825 3.073 20 70 DGIDHN C[C@H](NCCc1ccc(OC(F)(F)F)cc1)c1cnccn1 ZINC000161158317 432762768 /nfs/dbraw/zinc/76/27/68/432762768.db2.gz FDKCYHFGKJKQKT-NSHDSACASA-N 0 3 311.307 3.269 20 70 DGIDHN Cc1ccc([C@@H](C)NCCCc2nnc3n2CCCCC3)o1 ZINC000161185451 432764763 /nfs/dbraw/zinc/76/47/63/432764763.db2.gz FLXIEPJZJAITGV-CQSZACIVSA-N 0 3 302.422 3.189 20 70 DGIDHN C[C@H](NC(C)(C)CNC(=O)NC1(C)CCC1)c1ccccc1 ZINC000161217066 432766027 /nfs/dbraw/zinc/76/60/27/432766027.db2.gz UGFAOPUTHUWVLF-AWEZNQCLSA-N 0 3 303.450 3.358 20 70 DGIDHN CCCOc1c(Cl)cc(CN(CCC)CCO)cc1OC ZINC000161206584 432766903 /nfs/dbraw/zinc/76/69/03/432766903.db2.gz DIGQKZLWUTWVCS-UHFFFAOYSA-N 0 3 315.841 3.342 20 70 DGIDHN COC(CN1CCCCC[C@@H]1C[C@H](O)c1cccs1)OC ZINC000161459782 432779189 /nfs/dbraw/zinc/77/91/89/432779189.db2.gz CBLUSKKTBSCTOM-KGLIPLIRSA-N 0 3 313.463 3.035 20 70 DGIDHN c1nc2ccccn2c1CN(CCc1ccccc1)[C@H]1CCOC1 ZINC000161438919 432779726 /nfs/dbraw/zinc/77/97/26/432779726.db2.gz PDJXGUOTKUPSOI-SFHVURJKSA-N 0 3 321.424 3.168 20 70 DGIDHN CCCCO[C@@H]1C[C@@H](N[C@@H]2CCCc3c2cnn3C)C1(C)C ZINC000159803777 292800958 /nfs/dbraw/zinc/80/09/58/292800958.db2.gz AOVUXYBPAGGGIC-DJIMGWMZSA-N 0 3 305.466 3.371 20 70 DGIDHN CN1CCC(Oc2ccc(NCc3ccc(F)cc3)cn2)CC1 ZINC000160081780 292806918 /nfs/dbraw/zinc/80/69/18/292806918.db2.gz SENOAOVJGSUWQA-UHFFFAOYSA-N 0 3 315.392 3.306 20 70 DGIDHN C[C@@H](N[C@H]1CCO[C@@H]1C)c1ccc(Br)cc1F ZINC000217509810 337317898 /nfs/dbraw/zinc/31/78/98/337317898.db2.gz UZLGYAIZOBTSFB-KKFJDGPESA-N 0 3 302.187 3.416 20 70 DGIDHN COC[C@H](NCc1ccc(N2CCC(C)CC2)nc1)C(C)C ZINC000160502081 522751491 /nfs/dbraw/zinc/75/14/91/522751491.db2.gz CNXTYBODAUVEAY-KRWDZBQOSA-N 0 3 305.466 3.079 20 70 DGIDHN CSC[C@@H](CCO)N[C@H](C)c1cccc(C(F)(F)F)c1 ZINC000160316903 525641656 /nfs/dbraw/zinc/64/16/56/525641656.db2.gz KBLZFSRDIHVYRE-ZWNOBZJWSA-N 0 3 307.381 3.470 20 70 DGIDHN CCC[C@@H](N[C@H]1CCN(C(=O)C2CCCC2)C1)c1ccccn1 ZINC000159386231 546053421 /nfs/dbraw/zinc/05/34/21/546053421.db2.gz IDABNKMTUQIEGW-FUHWJXTLSA-N 0 3 315.461 3.304 20 70 DGIDHN C[C@@H](CC(=O)N1CCC[C@H]1CN1CCCCC1)c1ccncc1 ZINC000159909412 546057091 /nfs/dbraw/zinc/05/70/91/546057091.db2.gz BFDPOHZMSRVQBV-WMZOPIPTSA-N 0 3 315.461 3.052 20 70 DGIDHN COc1cc(CN[C@@H]2CCCOC2)ccc1OC1CCCC1 ZINC000160288843 546058995 /nfs/dbraw/zinc/05/89/95/546058995.db2.gz RFQLWTMFUBUCFZ-OAHLLOKOSA-N 0 3 305.418 3.285 20 70 DGIDHN CC(C)CN1CCO[C@@H](CN[C@@H](C)c2cc3ccccc3o2)C1 ZINC000216695946 546262684 /nfs/dbraw/zinc/26/26/84/546262684.db2.gz GHBWUIHQWAKJPH-RDJZCZTQSA-N 0 3 316.445 3.440 20 70 DGIDHN Cc1ncc([C@@H](C)NC[C@H](C)N2CCc3ccccc3C2)c(C)n1 ZINC000159805405 282164601 /nfs/dbraw/zinc/16/46/01/282164601.db2.gz QYDYHAIRVUPTJB-LSDHHAIUSA-N 0 3 324.472 3.191 20 70 DGIDHN CCN1CCCN(C(=O)N[C@@H](C)c2cc3ccccc3o2)CC1 ZINC000159552405 186126904 /nfs/dbraw/zinc/12/69/04/186126904.db2.gz MEAPGHDGGSNAEQ-AWEZNQCLSA-N 0 3 315.417 3.231 20 70 DGIDHN CN(C)CCN(Cc1ccccc1)C(=O)c1ccc(Cl)o1 ZINC000218627250 201541429 /nfs/dbraw/zinc/54/14/29/201541429.db2.gz SJUYPQQOTKYRNA-UHFFFAOYSA-N 0 3 306.793 3.137 20 70 DGIDHN CCN(C(=O)[C@H](C)[C@@H](N)c1ccccc1)c1nc(C)cs1 ZINC000160174229 284234597 /nfs/dbraw/zinc/23/45/97/284234597.db2.gz OSKWDGCYJZHQHT-TZMCWYRMSA-N 0 3 303.431 3.141 20 70 DGIDHN C[C@@H]1CN(Cc2ccccc2)C[C@@H]1Nc1nc(C2CC2)ns1 ZINC000160230681 197394148 /nfs/dbraw/zinc/39/41/48/197394148.db2.gz WKQVHUQDKMLQTN-DOMZBBRYSA-N 0 3 314.458 3.348 20 70 DGIDHN C[C@H](NCCN(C)Cc1ccc(F)cc1)c1cncc(F)c1 ZINC000160134872 197387658 /nfs/dbraw/zinc/38/76/58/197387658.db2.gz OAUOGGGFRSTPIQ-ZDUSSCGKSA-N 0 3 305.372 3.142 20 70 DGIDHN C[C@H](CN[C@H](C)c1cncc(F)c1)N1CCc2ccccc2C1 ZINC000159826616 197367290 /nfs/dbraw/zinc/36/72/90/197367290.db2.gz RNRZIINIOHOCLA-HUUCEWRRSA-N 0 3 313.420 3.318 20 70 DGIDHN CCN1CCCN(C(=O)N[C@H](c2ccccc2)C(C)C)CC1 ZINC000159559034 197361794 /nfs/dbraw/zinc/36/17/94/197361794.db2.gz KOOYFICZHPLLJX-KRWDZBQOSA-N 0 3 303.450 3.121 20 70 DGIDHN CCN1CCCN(C(=O)N[C@@H](c2ccccc2C)C(C)C)CC1 ZINC000159853754 285210958 /nfs/dbraw/zinc/21/09/58/285210958.db2.gz LXFXPEAEERDOHF-GOSISDBHSA-N 0 3 317.477 3.429 20 70 DGIDHN OCC[C@@H]1CCCCN1Cc1cccc(OC(F)(F)F)c1 ZINC000159741401 432694134 /nfs/dbraw/zinc/69/41/34/432694134.db2.gz BAMNVNKVZMWNCJ-ZDUSSCGKSA-N 0 3 303.324 3.322 20 70 DGIDHN CC(C)c1ncc(C(=O)N[C@H](C)CN2CCC[C@H](C)C2)s1 ZINC000159785243 432696199 /nfs/dbraw/zinc/69/61/99/432696199.db2.gz OUHAJAAXZFQMPY-QWHCGFSZSA-N 0 3 309.479 3.117 20 70 DGIDHN CC(=O)c1c(C)cc(C)c(CN(C)C[C@@H]2CCC[C@@H]2O)c1C ZINC000159873860 432699304 /nfs/dbraw/zinc/69/93/04/432699304.db2.gz DRGSRRMIIWGNLL-WMZOPIPTSA-N 0 3 303.446 3.407 20 70 DGIDHN CNC(=O)c1ccc(CN2CCC[C@@H]2c2cccc(C)n2)cc1 ZINC000160161813 432709012 /nfs/dbraw/zinc/70/90/12/432709012.db2.gz JQCLHKKNJZHXBL-GOSISDBHSA-N 0 3 309.413 3.087 20 70 DGIDHN CC1(C)C[C@H](NCc2cc(O)ccc2Br)CCO1 ZINC000160549290 432726403 /nfs/dbraw/zinc/72/64/03/432726403.db2.gz HGVJCGZHHFFQOR-LLVKDONJSA-N 0 3 314.223 3.202 20 70 DGIDHN O=C(NCCN1CCCCCC1)[C@H]1C[C@H]1c1cc(F)ccc1F ZINC000160221048 432712307 /nfs/dbraw/zinc/71/23/07/432712307.db2.gz UQLOKILOWNWIIS-HOCLYGCPSA-N 0 3 322.399 3.061 20 70 DGIDHN Fc1ccccc1-c1cnc(CN2CC[C@@H](N3CCCC3)C2)o1 ZINC000160335727 432715036 /nfs/dbraw/zinc/71/50/36/432715036.db2.gz PDTPSZVCWNSLDS-CQSZACIVSA-N 0 3 315.392 3.151 20 70 DGIDHN CCCCN(C)C(=O)N[C@H]1C[C@H](C)N(Cc2ccccc2)C1 ZINC000160342619 432716157 /nfs/dbraw/zinc/71/61/57/432716157.db2.gz MUHORULTGZTZNP-RDJZCZTQSA-N 0 3 303.450 3.091 20 70 DGIDHN CC[C@@H](C)CN(CC)[C@@H](C)C(=O)Nc1cc(OC)ccc1OC ZINC000160543958 432726597 /nfs/dbraw/zinc/72/65/97/432726597.db2.gz CIRVDERNFCOOPC-KGLIPLIRSA-N 0 3 322.449 3.399 20 70 DGIDHN C[C@H](NCc1ccccc1CN1CCOCC1)c1cccs1 ZINC000160454279 432721416 /nfs/dbraw/zinc/72/14/16/432721416.db2.gz VGYRTOMKROVOBQ-HNNXBMFYSA-N 0 3 316.470 3.431 20 70 DGIDHN Cc1nc2n(n1)C[C@@H](N[C@H](C)c1ccc(OC(C)C)cc1)CC2 ZINC000160491587 432723444 /nfs/dbraw/zinc/72/34/44/432723444.db2.gz GQJXJOTVXKUANO-CJNGLKHVSA-N 0 3 314.433 3.039 20 70 DGIDHN COCCOc1ccc(CN(C)Cc2cccc(F)c2)cc1 ZINC000160470256 432723655 /nfs/dbraw/zinc/72/36/55/432723655.db2.gz AEXRISUARVNCDI-UHFFFAOYSA-N 0 3 303.377 3.483 20 70 DGIDHN CC(C)N(CCN(C)C)C(=O)N[C@H](C)[C@H](C)c1ccccc1 ZINC000159388136 432681119 /nfs/dbraw/zinc/68/11/19/432681119.db2.gz KXTBZYPBZSCUQE-JKSUJKDBSA-N 0 3 305.466 3.160 20 70 DGIDHN CC(C)N(CCN(C)C)C(=O)N[C@@H](C)[C@@H](C)c1ccccc1 ZINC000159387740 432682410 /nfs/dbraw/zinc/68/24/10/432682410.db2.gz KXTBZYPBZSCUQE-CVEARBPZSA-N 0 3 305.466 3.160 20 70 DGIDHN Cc1cc(C)c(C(=O)NC[C@@H](c2ccccc2)N2CCCC2)[nH]1 ZINC000159665480 432691331 /nfs/dbraw/zinc/69/13/31/432691331.db2.gz CYDLDBDDXKVFDB-KRWDZBQOSA-N 0 3 311.429 3.198 20 70 DGIDHN Cc1ccc(C(=O)CCN2CC[C@@H](C)[C@H](n3ccnc3)C2)cc1 ZINC000160885559 432747160 /nfs/dbraw/zinc/74/71/60/432747160.db2.gz FWVSOJKNDNVPFW-SJLPKXTDSA-N 0 3 311.429 3.347 20 70 DGIDHN C[C@H](CC1CCOCC1)NCC(=O)Nc1ccc(Cl)cc1 ZINC000161117943 432761405 /nfs/dbraw/zinc/76/14/05/432761405.db2.gz UGQIYCIVQAGNRI-GFCCVEGCSA-N 0 3 310.825 3.073 20 70 DGIDHN CCN1CCCC[C@@H]1CN[C@@H](C)c1cc(OC)ccc1OC ZINC000161165518 432762453 /nfs/dbraw/zinc/76/24/53/432762453.db2.gz PSWPXJHHUZLFKD-LSDHHAIUSA-N 0 3 306.450 3.229 20 70 DGIDHN CCC(CC)(CN)C(=O)Nc1nc2c(s1)C(=O)CC(C)(C)C2 ZINC000161164326 432762872 /nfs/dbraw/zinc/76/28/72/432762872.db2.gz RGHAHRKZMWNLEN-UHFFFAOYSA-N 0 3 323.462 3.002 20 70 DGIDHN C[C@@H](Cc1ccc(Cl)cc1)C(=O)NC1CCN(C2CC2)CC1 ZINC000161293528 432771756 /nfs/dbraw/zinc/77/17/56/432771756.db2.gz LGRMCAJKLYTVHN-ZDUSSCGKSA-N 0 3 320.864 3.262 20 70 DGIDHN Cc1ccsc1[C@@H]1C[C@@H]1C(=O)N[C@@H](C)CN1CCCCC1 ZINC000161431634 432778045 /nfs/dbraw/zinc/77/80/45/432778045.db2.gz KWWAPSZSRSPTGP-ZNMIVQPWSA-N 0 3 306.475 3.151 20 70 DGIDHN C[C@@H](NC[C@H]1CCCC[C@@H]1O)c1cnn(Cc2ccccc2)c1 ZINC000160601355 432731165 /nfs/dbraw/zinc/73/11/65/432731165.db2.gz PABYKGWXLXLMAB-SUMDDJOVSA-N 0 3 313.445 3.133 20 70 DGIDHN Fc1cc(Cl)ccc1CNCCCOC[C@H]1CCCO1 ZINC000160668757 432733914 /nfs/dbraw/zinc/73/39/14/432733914.db2.gz YMYXYEXSKIYVNY-CQSZACIVSA-N 0 3 301.789 3.154 20 70 DGIDHN CC[C@@]1(C)C[C@H]1C(=O)NC1CCN(Cc2ccccc2)CC1 ZINC000160843380 432746097 /nfs/dbraw/zinc/74/60/97/432746097.db2.gz PMWJSKHOIQWWCH-HKUYNNGSSA-N 0 3 300.446 3.203 20 70 DGIDHN CC[C@@H](NCCNC(=O)C(C)C)c1cccc(Cl)c1F ZINC000161496178 432782995 /nfs/dbraw/zinc/78/29/95/432782995.db2.gz KBENIMFISPCXAC-CYBMUJFWSA-N 0 3 300.805 3.292 20 70 DGIDHN CCc1oc(C(=O)NCc2ccc(CN(C)C)cc2)cc1C ZINC000159714263 292798879 /nfs/dbraw/zinc/79/88/79/292798879.db2.gz MVWSQLVEDKPUIP-UHFFFAOYSA-N 0 3 300.402 3.142 20 70 DGIDHN CN(C)CCN(Cc1cccs1)c1nc(C(C)(C)C)ns1 ZINC000159964662 292804384 /nfs/dbraw/zinc/80/43/84/292804384.db2.gz FVSLOIDAPDVPBX-UHFFFAOYSA-N 0 3 324.519 3.465 20 70 DGIDHN CN(C)CCN(Cc1ccco1)C(=O)C1CCC(C)(C)CC1 ZINC000161147515 292829473 /nfs/dbraw/zinc/82/94/73/292829473.db2.gz NBOVCRPBQYQMLM-UHFFFAOYSA-N 0 3 306.450 3.386 20 70 DGIDHN CCSc1ccccc1[C@H](C)N[C@@H]1CCc2nc(C)nn2C1 ZINC000160406548 521781565 /nfs/dbraw/zinc/78/15/65/521781565.db2.gz FQIRPANBIZHFTO-GXTWGEPZSA-N 0 3 316.474 3.364 20 70 DGIDHN CCS[C@H]1CCC[C@@H](NC(=O)N(CCN(C)C)C(C)C)C1 ZINC000159421837 529228523 /nfs/dbraw/zinc/22/85/23/529228523.db2.gz GKFFAVNHWIRYDL-CABCVRRESA-N 0 3 315.527 3.032 20 70 DGIDHN CC(C)CN1CCO[C@H](CN[C@@H](C)c2ccc(Cl)cc2)C1 ZINC000216641548 575273472 /nfs/dbraw/zinc/27/34/72/575273472.db2.gz UYVXXNVWCMTTCB-WMLDXEAASA-N 0 3 310.869 3.347 20 70 DGIDHN Cc1nc2n(n1)C[C@H](N[C@@H](C)c1ccc(F)cc1Cl)CC2 ZINC000160384559 282125360 /nfs/dbraw/zinc/12/53/60/282125360.db2.gz QTIXETSGPBSYCF-JOYOIKCWSA-N 0 3 308.788 3.045 20 70 DGIDHN CS[C@H]1CCC[C@@H](NC(=O)[C@@H](C)[C@@H](N)c2ccccc2)C1 ZINC000159573104 186128116 /nfs/dbraw/zinc/12/81/16/186128116.db2.gz TVPHYJMYTSMDGJ-DRPJVOAASA-N 0 3 306.475 3.113 20 70 DGIDHN CSCC[C@@H](N)C(=O)N[C@@H](CC(C)C)c1ccccc1C ZINC000159695320 186135698 /nfs/dbraw/zinc/13/56/98/186135698.db2.gz MHKVRKHBYUICLG-CVEARBPZSA-N 0 3 308.491 3.279 20 70 DGIDHN C[C@@H](NC[C@@](C)(O)c1ccsc1)c1ccc2c(c1)OCO2 ZINC000160114906 197387131 /nfs/dbraw/zinc/38/71/31/197387131.db2.gz FFPZPYKAQUQVBE-BDJLRTHQSA-N 0 3 305.399 3.035 20 70 DGIDHN C[C@@H](NC[C@](C)(O)c1ccsc1)c1ccc([S@](C)=O)cc1 ZINC000160036898 197381212 /nfs/dbraw/zinc/38/12/12/197381212.db2.gz OHPZMLYWNDMUJE-PTPDTQQLSA-N 0 3 323.483 3.044 20 70 DGIDHN C[C@H](CN[C@H](C)c1cncc(F)c1)N1CCc2sccc2C1 ZINC000159872077 197370058 /nfs/dbraw/zinc/37/00/58/197370058.db2.gz PAQWXWRKKUFIIX-CHWSQXEVSA-N 0 3 319.449 3.380 20 70 DGIDHN C[C@@H](CC(=O)N1CC[C@H]2CC[C@@H](C1)N2C)c1ccc(F)cc1F ZINC000159443186 197354299 /nfs/dbraw/zinc/35/42/99/197354299.db2.gz INKHMPDDBPGGSS-CFVMTHIKSA-N 0 3 322.399 3.154 20 70 DGIDHN CC(C)[C@H](CO)N(Cc1cnc2ccccn12)Cc1ccccc1 ZINC000160468190 280261285 /nfs/dbraw/zinc/26/12/85/280261285.db2.gz ZFJVXYJNIFGJOD-IBGZPJMESA-N 0 3 323.440 3.353 20 70 DGIDHN C[C@@H]1C[C@@H](NC(=O)N(C)CC2CCC2)CN1Cc1ccccc1 ZINC000159914936 432701947 /nfs/dbraw/zinc/70/19/47/432701947.db2.gz BKKGCLQSNDLCSW-CRAIPNDOSA-N 0 3 315.461 3.091 20 70 DGIDHN COc1ccc([C@H](C)N[C@@H](CCO)CSC)cc1Cl ZINC000160224893 432711387 /nfs/dbraw/zinc/71/13/87/432711387.db2.gz HFXQKDRTFMGVIF-JQWIXIFHSA-N 0 3 303.855 3.113 20 70 DGIDHN CCN(CC1CC1)C(=O)N[C@H]1C[C@@H](C)N(Cc2ccccc2)C1 ZINC000160404750 432719715 /nfs/dbraw/zinc/71/97/15/432719715.db2.gz XXAUFIUMNAUOLQ-QAPCUYQASA-N 0 3 315.461 3.091 20 70 DGIDHN C[C@@H](CN[C@@H](C)c1cncc(F)c1)N(C)Cc1ccccc1 ZINC000160881626 432747212 /nfs/dbraw/zinc/74/72/12/432747212.db2.gz VTJKOIFPDVZBBQ-GJZGRUSLSA-N 0 3 301.409 3.392 20 70 DGIDHN COc1ccc(COCCCN[C@@H](C)c2cncs2)cc1 ZINC000161072133 432757912 /nfs/dbraw/zinc/75/79/12/432757912.db2.gz RTZMCOKQYWHRJI-ZDUSSCGKSA-N 0 3 306.431 3.409 20 70 DGIDHN CS(=O)(=O)CCCCNC(c1ccccc1)c1ccccc1 ZINC000161093779 432760360 /nfs/dbraw/zinc/76/03/60/432760360.db2.gz GBLRGLYMYGZOMO-UHFFFAOYSA-N 0 3 317.454 3.190 20 70 DGIDHN C[C@@H](c1cccnc1)N(C)CC1CCN(C(=O)C(C)(C)C)CC1 ZINC000161188809 432765365 /nfs/dbraw/zinc/76/53/65/432765365.db2.gz NYQZTGPTQSLSRP-HNNXBMFYSA-N 0 3 317.477 3.359 20 70 DGIDHN CCN1CCC(N(C)C(=O)c2[nH]c3ccc(C)cc3c2C)CC1 ZINC000161234147 432768140 /nfs/dbraw/zinc/76/81/40/432768140.db2.gz JFSACCICVSDWLX-UHFFFAOYSA-N 0 3 313.445 3.341 20 70 DGIDHN CC[C@H](C(=O)N1CCC[C@H]2CN(C)CC[C@@H]21)c1ccc(F)cc1 ZINC000161264305 432770359 /nfs/dbraw/zinc/77/03/59/432770359.db2.gz GJCNVSYMMXTNIV-SZMVWBNQSA-N 0 3 318.436 3.262 20 70 DGIDHN Cc1ccc(CN[C@H](C)c2ccc(N3CCCC3=O)cc2)cn1 ZINC000161315764 432773423 /nfs/dbraw/zinc/77/34/23/432773423.db2.gz NAUCHKKSRXMERJ-OAHLLOKOSA-N 0 3 309.413 3.368 20 70 DGIDHN COc1ccc(OC)c([C@H](C)NC[C@@H](CO)c2ccccc2)c1 ZINC000161425755 432777621 /nfs/dbraw/zinc/77/76/21/432777621.db2.gz OKISFLGWYORYNR-HOCLYGCPSA-N 0 3 315.413 3.131 20 70 DGIDHN COc1ccc(OC)c(CCN[C@H](C)c2cnc(C)nc2C)c1 ZINC000161416345 432778582 /nfs/dbraw/zinc/77/85/82/432778582.db2.gz LKYTYNCPWLHUOR-GFCCVEGCSA-N 0 3 315.417 3.004 20 70 DGIDHN C/C=C(/C=C/C(=O)Nc1ccnn1C1CCN(CC)CC1)CC ZINC000161447900 432778959 /nfs/dbraw/zinc/77/89/59/432778959.db2.gz RHTBGYPEXUMOBI-NXFQVUBDSA-N 0 3 316.449 3.391 20 70 DGIDHN Cc1cc(C)cc(CN2CCC([C@@H](O)C(F)(F)F)CC2)c1 ZINC000161454149 432779504 /nfs/dbraw/zinc/77/95/04/432779504.db2.gz NGXOLFWIECJSOD-OAHLLOKOSA-N 0 3 301.352 3.439 20 70 DGIDHN CCCC[C@@H](NCC(=O)NCC(F)(F)F)c1ccc(F)cc1 ZINC000160587692 432730566 /nfs/dbraw/zinc/73/05/66/432730566.db2.gz HBOCOKPHNLEIPU-CYBMUJFWSA-N 0 3 320.330 3.325 20 70 DGIDHN CCCCO[C@@H]1C[C@H](N[C@@H]2CCCc3c2cnn3C)C1(C)C ZINC000159803493 292800920 /nfs/dbraw/zinc/80/09/20/292800920.db2.gz AOVUXYBPAGGGIC-HYVNUMGLSA-N 0 3 305.466 3.371 20 70 DGIDHN Cc1ccc(CCNC(=O)c2ccc(CN(C)C)cc2)c(C)c1 ZINC000161283594 292832785 /nfs/dbraw/zinc/83/27/85/292832785.db2.gz HQNZULMKSGKZOS-UHFFFAOYSA-N 0 3 310.441 3.338 20 70 DGIDHN CCN1CCCN(C(=O)N[C@H]2CCC[C@@H]2c2ccccc2)CC1 ZINC000159851915 529030477 /nfs/dbraw/zinc/03/04/77/529030477.db2.gz NVYTZKXCJUYIIP-MSOLQXFVSA-N 0 3 315.461 3.060 20 70 DGIDHN CCOc1ccccc1[C@@H](C)NCCNC(=O)OC(C)(C)C ZINC000218165990 627104684 /nfs/dbraw/zinc/10/46/84/627104684.db2.gz POAWUTSRXWXUAJ-CYBMUJFWSA-N 0 3 308.422 3.261 20 70 DGIDHN CCN1CCCN(C(=O)N[C@@H](c2ccccc2)C(C)C)CC1 ZINC000159558887 186127152 /nfs/dbraw/zinc/12/71/52/186127152.db2.gz KOOYFICZHPLLJX-QGZVFWFLSA-N 0 3 303.450 3.121 20 70 DGIDHN CSc1cc(C)ccc1CNC(=O)N(CCN(C)C)C(C)C ZINC000159591861 186129885 /nfs/dbraw/zinc/12/98/85/186129885.db2.gz JPYOSIHCKRUSFV-UHFFFAOYSA-N 0 3 323.506 3.199 20 70 DGIDHN CC[C@H](CN[C@@H](CC)c1cnn(C)c1)Oc1ccccc1F ZINC000160304359 197398931 /nfs/dbraw/zinc/39/89/31/197398931.db2.gz INMHJHSZIRWTEE-ZBFHGGJFSA-N 0 3 305.397 3.458 20 70 DGIDHN CCc1nsc(N[C@@H]2CN(Cc3ccccc3)C[C@@H]2C)n1 ZINC000160246329 197395245 /nfs/dbraw/zinc/39/52/45/197395245.db2.gz QUGSWIGYYZZWPP-GXTWGEPZSA-N 0 3 302.447 3.033 20 70 DGIDHN COc1ccc2c(c1)[C@H](NC[C@](C)(O)c1ccsc1)CC2 ZINC000159945000 197375540 /nfs/dbraw/zinc/37/55/40/197375540.db2.gz URRUQPIJMMNQQC-SJORKVTESA-N 0 3 303.427 3.241 20 70 DGIDHN C[C@@H](CN[C@@H](C)c1cncc(F)c1)N1CCc2ccccc2C1 ZINC000159826205 197367206 /nfs/dbraw/zinc/36/72/06/197367206.db2.gz RNRZIINIOHOCLA-GJZGRUSLSA-N 0 3 313.420 3.318 20 70 DGIDHN Cc1ccc(-c2ccc(CN3CCC(CC(N)=O)CC3)o2)cc1 ZINC000159824351 197367569 /nfs/dbraw/zinc/36/75/69/197367569.db2.gz VBIGKYJNEGALCE-UHFFFAOYSA-N 0 3 312.413 3.342 20 70 DGIDHN Cc1ccc(-c2cc(CN(C)C[C@@H]3CCC[C@@H]3O)on2)cc1 ZINC000159817631 197366223 /nfs/dbraw/zinc/36/62/23/197366223.db2.gz FVWOQEKHOPGULC-YJBOKZPZSA-N 0 3 300.402 3.243 20 70 DGIDHN Cc1cc(C)cc(CCC(=O)N2CCC[C@H]3CN(C)CC[C@H]32)c1 ZINC000159766508 197362262 /nfs/dbraw/zinc/36/22/62/197362262.db2.gz TUIURURAJQJWPU-RBUKOAKNSA-N 0 3 314.473 3.179 20 70 DGIDHN CC[C@H](N[C@H](C)C(=O)NCc1ccco1)c1ccc(F)cc1 ZINC000160833972 400735898 /nfs/dbraw/zinc/73/58/98/400735898.db2.gz JVCHSYQWBRXOJK-WBMJQRKESA-N 0 3 304.365 3.164 20 70 DGIDHN CCCO[C@@H]1CCCN(Cc2cc(C)c(C(=O)OC)o2)CC1 ZINC000217005551 165377070 /nfs/dbraw/zinc/37/70/70/165377070.db2.gz XZZTWWWFRRSOCT-CQSZACIVSA-N 0 3 309.406 3.156 20 70 DGIDHN CC1CCC(N2CCN(Cc3noc4c3CCCC4)CC2)CC1 ZINC000217213958 432654257 /nfs/dbraw/zinc/65/42/57/432654257.db2.gz QSWYQKXPUNFZKE-UHFFFAOYSA-N 0 3 317.477 3.250 20 70 DGIDHN CCc1ccc([C@H](CNC(=O)c2[nH]c(C)cc2C)N(C)C)cc1 ZINC000159654119 432692726 /nfs/dbraw/zinc/69/27/26/432692726.db2.gz TVPMUSUGCLTYNA-KRWDZBQOSA-N 0 3 313.445 3.227 20 70 DGIDHN COc1ccc(CN(C)Cc2c[nH]nc2-c2cccnc2)cc1 ZINC000159867664 432699463 /nfs/dbraw/zinc/69/94/63/432699463.db2.gz JDAMJYFTWHZZGS-UHFFFAOYSA-N 0 3 308.385 3.112 20 70 DGIDHN CC(=O)c1c(C)cc(C)c(CN(C)C[C@H]2CCC[C@@H]2O)c1C ZINC000159874003 432699600 /nfs/dbraw/zinc/69/96/00/432699600.db2.gz DRGSRRMIIWGNLL-AEFFLSMTSA-N 0 3 303.446 3.407 20 70 DGIDHN CC(C)N(C(=O)N[C@H]1CN(Cc2ccccc2)C[C@H]1C)C1CC1 ZINC000159979732 432702869 /nfs/dbraw/zinc/70/28/69/432702869.db2.gz FGKHTAVVGRHYMV-QAPCUYQASA-N 0 3 315.461 3.089 20 70 DGIDHN CC(C)N(C(=O)N[C@H]1CN(Cc2ccccc2)C[C@@H]1C)C1CC1 ZINC000159979855 432703696 /nfs/dbraw/zinc/70/36/96/432703696.db2.gz FGKHTAVVGRHYMV-YJBOKZPZSA-N 0 3 315.461 3.089 20 70 DGIDHN COc1ccc([C@@H](C)N[C@H](CCO)CSC)cc1Cl ZINC000160225266 432711582 /nfs/dbraw/zinc/71/15/82/432711582.db2.gz HFXQKDRTFMGVIF-ZYHUDNBSSA-N 0 3 303.855 3.113 20 70 DGIDHN CCN(CC1CC1)C(=O)N[C@@H]1C[C@@H](C)N(Cc2ccccc2)C1 ZINC000160404633 432718861 /nfs/dbraw/zinc/71/88/61/432718861.db2.gz XXAUFIUMNAUOLQ-CRAIPNDOSA-N 0 3 315.461 3.091 20 70 DGIDHN COCCN(C)CCN[C@H](C)c1ccc(-c2ccccc2)o1 ZINC000159415341 432684142 /nfs/dbraw/zinc/68/41/42/432684142.db2.gz SUPZCWSMQZKQTI-OAHLLOKOSA-N 0 3 302.418 3.175 20 70 DGIDHN CN(Cc1ccc(Br)cc1F)C[C@H]1CCC[C@@H]1O ZINC000159602434 432688745 /nfs/dbraw/zinc/68/87/45/432688745.db2.gz ZOEAUTBTLUGVSF-RISCZKNCSA-N 0 3 316.214 3.181 20 70 DGIDHN CC(C)[C@@H](N[C@H](C)c1cnn(C)c1)c1ccc2c(c1)OCCO2 ZINC000161026423 432754072 /nfs/dbraw/zinc/75/40/72/432754072.db2.gz ORAXSPVZXULNEH-FZKQIMNGSA-N 0 3 315.417 3.239 20 70 DGIDHN C[C@@H](C(=O)N[C@@H]1CCOC2(CCCCC2)C1)N1[C@H](C)CC[C@@H]1C ZINC000161024962 432754439 /nfs/dbraw/zinc/75/44/39/432754439.db2.gz IUICYORXZPPWEH-VVLHAWIVSA-N 0 3 322.493 3.246 20 70 DGIDHN CC[C@H](N)C(=O)N(CC)[C@@H](C)c1cccc(C(F)(F)F)c1 ZINC000161116186 432759639 /nfs/dbraw/zinc/75/96/39/432759639.db2.gz LNCPFDODCAZXDI-GWCFXTLKSA-N 0 3 302.340 3.352 20 70 DGIDHN C[C@H](NCCCc1nnc2n1CCCCC2)c1ccccc1F ZINC000161129730 432761875 /nfs/dbraw/zinc/76/18/75/432761875.db2.gz JWXKLPZPUOFFDG-AWEZNQCLSA-N 0 3 316.424 3.427 20 70 DGIDHN Cc1ccoc1C(=O)NCCCN[C@@H](C)c1ccc(F)cc1F ZINC000161216955 432766923 /nfs/dbraw/zinc/76/69/23/432766923.db2.gz ORWRPHWXRSXMFZ-LBPRGKRZSA-N 0 3 322.355 3.337 20 70 DGIDHN CC(C)(C)[C@H](N)C(=O)Nc1ccc(OC2CCCC2)c(F)c1 ZINC000161334624 432772819 /nfs/dbraw/zinc/77/28/19/432772819.db2.gz KTABNSJAHWJKAN-OAHLLOKOSA-N 0 3 308.397 3.459 20 70 DGIDHN Cc1nccc(Nc2cccc(N3CCN(C(C)C)CC3)c2)n1 ZINC000161321752 432773814 /nfs/dbraw/zinc/77/38/14/432773814.db2.gz PHNGYJLIPMRSQE-UHFFFAOYSA-N 0 3 311.433 3.059 20 70 DGIDHN CC(C)n1ncc2cc(CN3CCC(c4cc[nH]n4)CC3)cnc21 ZINC000160545850 432727044 /nfs/dbraw/zinc/72/70/44/432727044.db2.gz MYJRPYIBFDFTPZ-UHFFFAOYSA-N 0 3 324.432 3.115 20 70 DGIDHN CC[C@@H](NCc1cccc(C(=O)NC)c1)c1ccc(F)cc1 ZINC000160725229 432737576 /nfs/dbraw/zinc/73/75/76/432737576.db2.gz UHGNSOUUHQXRNR-QGZVFWFLSA-N 0 3 300.377 3.426 20 70 DGIDHN CCCCN(CC1CCC(C)CC1)[C@@H]1CCS(=O)(=O)C1 ZINC000160794563 432743200 /nfs/dbraw/zinc/74/32/00/432743200.db2.gz DQMGVFHWJSEBFF-UYSNPLJNSA-N 0 3 301.496 3.102 20 70 DGIDHN CC[C@@]1(C)C[C@H]1C(=O)N(Cc1ccco1)C1CCN(C)CC1 ZINC000160849589 432746274 /nfs/dbraw/zinc/74/62/74/432746274.db2.gz JZWXRUZAEPVDMV-WMZOPIPTSA-N 0 3 304.434 3.139 20 70 DGIDHN CC1CCC(CN[C@@H](CS(C)(=O)=O)c2ccccc2)CC1 ZINC000159603873 292796309 /nfs/dbraw/zinc/79/63/09/292796309.db2.gz VQFMYFHTCSFBLW-DQPZFDDXSA-N 0 3 309.475 3.188 20 70 DGIDHN Cc1ccc(CNc2ccc(OC3CCN(C)CC3)nc2)cc1 ZINC000160068632 292806958 /nfs/dbraw/zinc/80/69/58/292806958.db2.gz OICGAUWRSUJVMD-UHFFFAOYSA-N 0 3 311.429 3.475 20 70 DGIDHN CCSc1ccccc1[C@H](C)N[C@H]1CCc2nc(C)nn2C1 ZINC000160406805 521783467 /nfs/dbraw/zinc/78/34/67/521783467.db2.gz FQIRPANBIZHFTO-JSGCOSHPSA-N 0 3 316.474 3.364 20 70 DGIDHN CCN1CCCN(C(=O)NCC(C)(C)c2ccccc2C)CC1 ZINC000159793032 529022367 /nfs/dbraw/zinc/02/23/67/529022367.db2.gz BDIYWZZAXLSFMW-UHFFFAOYSA-N 0 3 317.477 3.010 20 70 DGIDHN CCC[C@H](N[C@H]1CCN(C(=O)C2CCCC2)C1)c1ccccn1 ZINC000159386103 546053256 /nfs/dbraw/zinc/05/32/56/546053256.db2.gz IDABNKMTUQIEGW-WMZOPIPTSA-N 0 3 315.461 3.304 20 70 DGIDHN Cc1ccc(NC(=O)N(CCN(C)C)Cc2cccs2)cn1 ZINC000161424926 546069039 /nfs/dbraw/zinc/06/90/39/546069039.db2.gz RXGKZQLBUGDSMF-UHFFFAOYSA-N 0 3 318.446 3.047 20 70 DGIDHN Cc1cc(NC(=O)[C@@H]2CCCCN2)ccc1OCC(F)(F)F ZINC000159565910 186127355 /nfs/dbraw/zinc/12/73/55/186127355.db2.gz WXVXLTVDBUTCIC-LBPRGKRZSA-N 0 3 316.323 3.017 20 70 DGIDHN CCc1nsc(N[C@H]2CN(Cc3ccccc3)C[C@@H]2C)n1 ZINC000160246461 197395280 /nfs/dbraw/zinc/39/52/80/197395280.db2.gz QUGSWIGYYZZWPP-JSGCOSHPSA-N 0 3 302.447 3.033 20 70 DGIDHN CCN(CC)[C@H](CNCc1ccnn1CC)c1ccccc1 ZINC000159873613 197369870 /nfs/dbraw/zinc/36/98/70/197369870.db2.gz RGPGLHJLAZGUDR-GOSISDBHSA-N 0 3 300.450 3.076 20 70 DGIDHN CCN1CCCN(C(=O)N[C@@H](C)c2ccccc2Cl)CC1 ZINC000159529127 197360906 /nfs/dbraw/zinc/36/09/06/197360906.db2.gz DIOCJFITVMKIAJ-ZDUSSCGKSA-N 0 3 309.841 3.138 20 70 DGIDHN O=C(Nc1ccc(COCc2ccccc2)cc1)[C@@H]1CCCCN1 ZINC000159515009 197360016 /nfs/dbraw/zinc/36/00/16/197360016.db2.gz GBRZWEIIFXVBQH-IBGZPJMESA-N 0 3 324.424 3.484 20 70 DGIDHN OCC1(CNCc2ccc(F)cc2C(F)(F)F)CCCC1 ZINC000160124368 285247240 /nfs/dbraw/zinc/24/72/40/285247240.db2.gz TXAJFCVUESSUGZ-UHFFFAOYSA-N 0 3 305.315 3.487 20 70 DGIDHN CN(CCOc1ccc(Cl)cc1)C[C@@H](O)Cc1ccccc1 ZINC000218689496 432660752 /nfs/dbraw/zinc/66/07/52/432660752.db2.gz YGQOKRFWBAXQIV-KRWDZBQOSA-N 0 3 319.832 3.254 20 70 DGIDHN Cc1cccc(C(=O)NCc2ccc(CN(C)C)cc2)c1F ZINC000159712388 432694384 /nfs/dbraw/zinc/69/43/84/432694384.db2.gz LHLKLTBEMPGQMA-UHFFFAOYSA-N 0 3 300.377 3.126 20 70 DGIDHN Cc1ccc(CN(C(=O)CN2CC[C@@H]3CCCC[C@@H]32)C2CC2)o1 ZINC000159722297 432694561 /nfs/dbraw/zinc/69/45/61/432694561.db2.gz FRFBSVAXNZSTHV-YJBOKZPZSA-N 0 3 316.445 3.344 20 70 DGIDHN C[C@@H]1CN(C[C@H](O)Cc2ccc(C(F)(F)F)cc2)CCS1 ZINC000159842210 432698157 /nfs/dbraw/zinc/69/81/57/432698157.db2.gz HUACREJJIUQRDM-BXUZGUMPSA-N 0 3 319.392 3.046 20 70 DGIDHN COc1cccc(CCCN2CCC(c3noc(C)n3)CC2)c1 ZINC000159993202 432703770 /nfs/dbraw/zinc/70/37/70/432703770.db2.gz RGUSXKNAUQKIFU-UHFFFAOYSA-N 0 3 315.417 3.199 20 70 DGIDHN Cc1cccc(CNC(=O)N(CCN(C)C)C2CCCC2)c1 ZINC000159975294 432703876 /nfs/dbraw/zinc/70/38/76/432703876.db2.gz FHABREGYGGUFDJ-UHFFFAOYSA-N 0 3 303.450 3.011 20 70 DGIDHN CC[C@H](C(=O)N[C@@H]1CCSc2ccc(Cl)cc21)N(C)C ZINC000160095020 432706107 /nfs/dbraw/zinc/70/61/07/432706107.db2.gz CEQGTFODYHJXMB-CHWSQXEVSA-N 0 3 312.866 3.333 20 70 DGIDHN CSC[C@@H](CCO)N[C@@H](C)c1cc(C)ccc1OC(F)F ZINC000160214352 432711764 /nfs/dbraw/zinc/71/17/64/432711764.db2.gz ZQDODXBOOKVBIM-NWDGAFQWSA-N 0 3 319.417 3.361 20 70 DGIDHN CCCCN(C)C(=O)N[C@@H]1C[C@H](C)N(Cc2ccccc2)C1 ZINC000160342490 432715394 /nfs/dbraw/zinc/71/53/94/432715394.db2.gz MUHORULTGZTZNP-DOTOQJQBSA-N 0 3 303.450 3.091 20 70 DGIDHN Cc1nc2n(n1)C[C@H](N[C@H](C)c1ccc(F)cc1Cl)CC2 ZINC000160384787 432717887 /nfs/dbraw/zinc/71/78/87/432717887.db2.gz QTIXETSGPBSYCF-BXKDBHETSA-N 0 3 308.788 3.045 20 70 DGIDHN C[C@H](Cc1cccs1)NC(=O)N(CCN(C)C)C1CCCC1 ZINC000160413396 432719637 /nfs/dbraw/zinc/71/96/37/432719637.db2.gz JSMWMGWOJWAIHZ-CQSZACIVSA-N 0 3 323.506 3.195 20 70 DGIDHN Cc1nc2n(n1)C[C@H](N[C@H](C)c1cccc(C(F)(F)F)c1)CC2 ZINC000160483800 432722446 /nfs/dbraw/zinc/72/24/46/432722446.db2.gz WTDDDWKAANNNNB-QMTHXVAHSA-N 0 3 324.350 3.271 20 70 DGIDHN C[C@@H](C(=O)NCCc1cc2ccccc2o1)[C@@H](N)c1ccccc1 ZINC000160487657 432723321 /nfs/dbraw/zinc/72/33/21/432723321.db2.gz ATPGHCQFVBAUDY-AUUYWEPGSA-N 0 3 322.408 3.428 20 70 DGIDHN C[C@@H](C(=O)NCCc1cc2ccccc2[nH]1)N1CCCCCC1 ZINC000159573896 432687868 /nfs/dbraw/zinc/68/78/68/432687868.db2.gz GWOQTXHYPLGKAK-HNNXBMFYSA-N 0 3 313.445 3.091 20 70 DGIDHN O=C(CN1CC[C@@H]2CCCC[C@@H]21)Nc1ccccc1OC(F)F ZINC000159631684 432690407 /nfs/dbraw/zinc/69/04/07/432690407.db2.gz PVDRAHZHVWAHOD-JSGCOSHPSA-N 0 3 324.371 3.491 20 70 DGIDHN CC[C@H](NCC(=O)NC(C)C)c1ccc2cc(OC)ccc2c1 ZINC000160942554 432751530 /nfs/dbraw/zinc/75/15/30/432751530.db2.gz CWLRUIWBNVCYAD-SFHVURJKSA-N 0 3 314.429 3.414 20 70 DGIDHN CC[C@H](C(=O)N1CC=C(c2c[nH]c3ccccc32)CC1)N(C)C ZINC000161049228 432755959 /nfs/dbraw/zinc/75/59/59/432755959.db2.gz OEYKNASVJMPMPN-GOSISDBHSA-N 0 3 311.429 3.124 20 70 DGIDHN CCn1cc([C@H](C)NCCCOCc2ccc(OC)cc2)cn1 ZINC000161086804 432757651 /nfs/dbraw/zinc/75/76/51/432757651.db2.gz CKXRLMGCMWDQJG-HNNXBMFYSA-N 0 3 317.433 3.169 20 70 DGIDHN CCCN(CC1CCC(C)(C)CC1)[C@H]1CCS(=O)(=O)C1 ZINC000161096126 432759904 /nfs/dbraw/zinc/75/99/04/432759904.db2.gz ORKGDRJFJHAJRC-HNNXBMFYSA-N 0 3 301.496 3.102 20 70 DGIDHN CN1CCC(C(=O)NC2(c3ccc(F)cc3F)CCCC2)CC1 ZINC000161143122 432761756 /nfs/dbraw/zinc/76/17/56/432761756.db2.gz OSJHAKYCVWCOSN-UHFFFAOYSA-N 0 3 322.399 3.192 20 70 DGIDHN C[C@@H](NCCc1ccc(OC(F)(F)F)cc1)c1cnccn1 ZINC000161158436 432763851 /nfs/dbraw/zinc/76/38/51/432763851.db2.gz FDKCYHFGKJKQKT-LLVKDONJSA-N 0 3 311.307 3.269 20 70 DGIDHN C[C@@H](N[C@@H](C)CSC(C)(C)C)C(=O)NCc1ccccc1 ZINC000161194218 432765920 /nfs/dbraw/zinc/76/59/20/432765920.db2.gz WZPAXYQFZFLYER-UONOGXRCSA-N 0 3 308.491 3.201 20 70 DGIDHN CCO[C@H]1C[C@H](N(C)Cc2c(C)nc3ccccn32)C1(C)C ZINC000160570415 432729676 /nfs/dbraw/zinc/72/96/76/432729676.db2.gz LTWWPPFESDDMBT-HOTGVXAUSA-N 0 3 301.434 3.278 20 70 DGIDHN CC[C@H](NCCNC(=O)c1ccccc1)c1ccc(F)cc1 ZINC000160711109 432737654 /nfs/dbraw/zinc/73/76/54/432737654.db2.gz VFFAIGSEEPTHPY-KRWDZBQOSA-N 0 3 300.377 3.296 20 70 DGIDHN CC[C@@H](NCCNC(=O)c1ccccc1)c1ccc(F)cc1 ZINC000160711211 432737733 /nfs/dbraw/zinc/73/77/33/432737733.db2.gz VFFAIGSEEPTHPY-QGZVFWFLSA-N 0 3 300.377 3.296 20 70 DGIDHN CCN(CC)[C@H](CNC(=O)C1=CCCC1)c1cccc(OC)c1 ZINC000160245187 292810809 /nfs/dbraw/zinc/81/08/09/292810809.db2.gz OEVCZIHDUZTQQE-GOSISDBHSA-N 0 3 316.445 3.305 20 70 DGIDHN CN(C)Cc1ccc(C(=O)N(C)CCc2ccc(F)cc2)cc1 ZINC000160966730 292825335 /nfs/dbraw/zinc/82/53/35/292825335.db2.gz CQECTCWTBQNZKX-UHFFFAOYSA-N 0 3 314.404 3.202 20 70 DGIDHN C[C@H](Cc1ccc(Cl)cc1)C(=O)NC1CCN(C2CC2)CC1 ZINC000161293633 292832649 /nfs/dbraw/zinc/83/26/49/292832649.db2.gz LGRMCAJKLYTVHN-CYBMUJFWSA-N 0 3 320.864 3.262 20 70 DGIDHN Cc1ccc(CN[C@H](C)c2ccc3c(c2)C(C)(C)C(=O)N3)cn1 ZINC000161274748 292832777 /nfs/dbraw/zinc/83/27/77/292832777.db2.gz XITCQIFEUDCUBE-CYBMUJFWSA-N 0 3 309.413 3.471 20 70 DGIDHN Cc1cc([C@H](C)NC(=O)c2ccc(CN(C)C)cc2)c(C)o1 ZINC000161419368 292835127 /nfs/dbraw/zinc/83/51/27/292835127.db2.gz PBCXORVOYMTCIW-ZDUSSCGKSA-N 0 3 300.402 3.449 20 70 DGIDHN CCN1CCCN(C(=O)NC[C@@H](c2ccccc2)C(C)C)CC1 ZINC000159679333 529024865 /nfs/dbraw/zinc/02/48/65/529024865.db2.gz YGZASCHNBNCQOE-GOSISDBHSA-N 0 3 317.477 3.163 20 70 DGIDHN Cc1nccc(NC(=O)N(CCN(C)C)CC(C)C)c1Cl ZINC000159840013 546056239 /nfs/dbraw/zinc/05/62/39/546056239.db2.gz BXCXLRWOBQVKCE-UHFFFAOYSA-N 0 3 312.845 3.095 20 70 DGIDHN CCN(C(=O)NC1CC=CC1)[C@@H]1CCN(Cc2ccccc2)C1 ZINC000160723214 546061884 /nfs/dbraw/zinc/06/18/84/546061884.db2.gz JLKMMQUCBAHSFB-GOSISDBHSA-N 0 3 313.445 3.011 20 70 DGIDHN CCN(C(=O)NC1CC=CC1)[C@H]1CCN(Cc2ccccc2)C1 ZINC000160723343 546062004 /nfs/dbraw/zinc/06/20/04/546062004.db2.gz JLKMMQUCBAHSFB-SFHVURJKSA-N 0 3 313.445 3.011 20 70 DGIDHN Cc1ccc(CN[C@@H](C)Cn2cc(Br)cn2)s1 ZINC000160924487 197450999 /nfs/dbraw/zinc/45/09/99/197450999.db2.gz NRXVZYKFUKGLTR-VIFPVBQESA-N 0 3 314.252 3.194 20 70 DGIDHN Cc1ncc([C@H](C)NCCN(C)Cc2ccc(F)cc2)c(C)n1 ZINC000160119754 197387000 /nfs/dbraw/zinc/38/70/00/197387000.db2.gz WABGWUQXJDEYPG-ZDUSSCGKSA-N 0 3 316.424 3.015 20 70 DGIDHN COCCOc1ccc(CN(C)Cc2ccc(OC)cc2)cc1 ZINC000159869484 197370420 /nfs/dbraw/zinc/37/04/20/197370420.db2.gz QJSXSJIVYJCJDZ-UHFFFAOYSA-N 0 3 315.413 3.352 20 70 DGIDHN C[C@H](CN[C@@H](C)c1cncc(F)c1)N1CCc2ccccc2C1 ZINC000159826304 197366973 /nfs/dbraw/zinc/36/69/73/197366973.db2.gz RNRZIINIOHOCLA-CABCVRRESA-N 0 3 313.420 3.318 20 70 DGIDHN Cc1c2ccccc2oc1[C@@H](C)NCCCN1CCCC1=O ZINC000159495553 197357832 /nfs/dbraw/zinc/35/78/32/197357832.db2.gz DNZXOKNILLDNRG-CQSZACIVSA-N 0 3 300.402 3.404 20 70 DGIDHN CN1CCC[C@H](CNC(=O)C2(c3cccs3)CCCCC2)C1 ZINC000159511244 400730006 /nfs/dbraw/zinc/73/00/06/400730006.db2.gz NUHWIJIJJSABRZ-OAHLLOKOSA-N 0 3 320.502 3.408 20 70 DGIDHN CCc1ccc([C@H](C)CC(=O)N[C@H]2CCN(CC3CC3)C2)cc1 ZINC000159495284 400730075 /nfs/dbraw/zinc/73/00/75/400730075.db2.gz CWAUEFQNWPPWPZ-BEFAXECRSA-N 0 3 314.473 3.343 20 70 DGIDHN Cc1cccc(C(C)(C)NC(=O)N[C@H]2CCN(CC3CC3)C2)c1 ZINC000160662727 400734558 /nfs/dbraw/zinc/73/45/58/400734558.db2.gz HFEMPSZSERVXSS-KRWDZBQOSA-N 0 3 315.461 3.014 20 70 DGIDHN CC(C)N(Cc1ccccc1)C(=O)N[C@@H]1CCN(CC2CC2)C1 ZINC000160651954 400734669 /nfs/dbraw/zinc/73/46/69/400734669.db2.gz JHHBJKAYMIBVIB-GOSISDBHSA-N 0 3 315.461 3.091 20 70 DGIDHN c1cc2c(c([C@@H]3CCCN3CCOCC3CC3)c1)OCCO2 ZINC000160397939 228246577 /nfs/dbraw/zinc/24/65/77/228246577.db2.gz ZCRMUEVSGYVSKG-INIZCTEOSA-N 0 3 303.402 3.021 20 70 DGIDHN CCN(CC)C(=O)C[C@@H](C)N[C@@H]1CCOc2c(Cl)cccc21 ZINC000161289247 276090398 /nfs/dbraw/zinc/09/03/98/276090398.db2.gz PHTATFVWLJISKH-IUODEOHRSA-N 0 3 324.852 3.400 20 70 DGIDHN C[C@@H](N[C@@H]1CCO[C@@H]1C)c1ccc(Br)cc1F ZINC000217509729 432656390 /nfs/dbraw/zinc/65/63/90/432656390.db2.gz UZLGYAIZOBTSFB-JRKPZEMJSA-N 0 3 302.187 3.416 20 70 DGIDHN O=C(Cc1ccsc1)N1CCCN(Cc2ccccc2)CC1 ZINC000218499918 432658119 /nfs/dbraw/zinc/65/81/19/432658119.db2.gz YBFFXDYPXGZCAY-UHFFFAOYSA-N 0 3 314.454 3.025 20 70 DGIDHN CC(C)N(CCN(C)C)C(=O)N[C@@H]1CC(C)(C)c2ccccc21 ZINC000159789850 432695366 /nfs/dbraw/zinc/69/53/66/432695366.db2.gz BJROJJHFLLDOSR-QGZVFWFLSA-N 0 3 317.477 3.391 20 70 DGIDHN CSC[C@@H](CCO)N[C@@H](C)c1sc(C(C)C)nc1C ZINC000160201776 432709530 /nfs/dbraw/zinc/70/95/30/432709530.db2.gz WBHVRWODABVNCB-CMPLNLGQSA-N 0 3 302.509 3.340 20 70 DGIDHN CCc1oc2ccccc2c1CN(C)C(=O)[C@H](CC)N(C)C ZINC000159441228 432683414 /nfs/dbraw/zinc/68/34/14/432683414.db2.gz ULVSKAFSAZYNKJ-HNNXBMFYSA-N 0 3 302.418 3.294 20 70 DGIDHN CC[C@H](CC(=O)NC[C@@H]1CCCN(C)C1)c1ccc(C)cc1 ZINC000159509747 432685356 /nfs/dbraw/zinc/68/53/56/432685356.db2.gz OUIHZBIOBNZLIE-DLBZAZTESA-N 0 3 302.462 3.337 20 70 DGIDHN CCS[C@@H]1CCCC[C@H]1NC(=O)N(CCN(C)C)C(C)C ZINC000159489169 432685896 /nfs/dbraw/zinc/68/58/96/432685896.db2.gz PMSYQQZMICDHEG-HUUCEWRRSA-N 0 3 315.527 3.032 20 70 DGIDHN CC(C)[C@H](CNC(=O)[C@@H](C)N)Cc1ccc(Cl)cc1Cl ZINC000159532941 432687287 /nfs/dbraw/zinc/68/72/87/432687287.db2.gz DHEXJXLWDXELNT-PWSUYJOCSA-N 0 3 317.260 3.272 20 70 DGIDHN Cc1ccc(CN[C@H](C)Cn2cc(Br)cn2)s1 ZINC000160924581 432749007 /nfs/dbraw/zinc/74/90/07/432749007.db2.gz NRXVZYKFUKGLTR-SECBINFHSA-N 0 3 314.252 3.194 20 70 DGIDHN CC(C)OCCN1CCC(NC(=O)C2CCC(C)(C)CC2)CC1 ZINC000160918710 432749648 /nfs/dbraw/zinc/74/96/48/432749648.db2.gz KZURNIUXAUPTMN-UHFFFAOYSA-N 0 3 324.509 3.208 20 70 DGIDHN C[C@H](NCc1ccccc1CS(C)(=O)=O)c1cccs1 ZINC000160933606 432749911 /nfs/dbraw/zinc/74/99/11/432749911.db2.gz KFMZZEVDSKSIFV-LBPRGKRZSA-N 0 3 309.456 3.144 20 70 DGIDHN Cc1ccc(CN(C)C)cc1NC(=O)C[C@@H]1CSCCS1 ZINC000160944208 432750545 /nfs/dbraw/zinc/75/05/45/432750545.db2.gz MCQPTPYMATWBCX-CQSZACIVSA-N 0 3 324.515 3.234 20 70 DGIDHN Cc1ccc(CN(C)C)cc1NC(=O)C[C@H]1CSCCS1 ZINC000160944342 432750756 /nfs/dbraw/zinc/75/07/56/432750756.db2.gz MCQPTPYMATWBCX-AWEZNQCLSA-N 0 3 324.515 3.234 20 70 DGIDHN CCCN(CCO)Cc1c(C)nn(Cc2ccc(C)cc2)c1C ZINC000161207766 432766314 /nfs/dbraw/zinc/76/63/14/432766314.db2.gz JHWPXKJUFNEPQS-UHFFFAOYSA-N 0 3 315.461 3.061 20 70 DGIDHN Cc1ccccc1OCCN[C@H](C)c1ccc([S@](C)=O)cc1 ZINC000161351388 432774286 /nfs/dbraw/zinc/77/42/86/432774286.db2.gz LLQHPPURTSXDCL-IVZQSRNASA-N 0 3 317.454 3.462 20 70 DGIDHN CC[C@@H](C)CN(CC)[C@@H](C)C(=O)Nc1ccc(OC)cc1OC ZINC000160563273 432728055 /nfs/dbraw/zinc/72/80/55/432728055.db2.gz QEMYQIINHVQJJP-KGLIPLIRSA-N 0 3 322.449 3.399 20 70 DGIDHN CC[C@H](C)CN(CC)[C@@H](C)C(=O)Nc1ccc(OC)cc1OC ZINC000160563393 432728965 /nfs/dbraw/zinc/72/89/65/432728965.db2.gz QEMYQIINHVQJJP-KBPBESRZSA-N 0 3 322.449 3.399 20 70 DGIDHN CC[C@H](C(=O)N1CC[C@H]2CC[C@@H](C1)N2C)c1ccc(F)cc1 ZINC000160638162 432732542 /nfs/dbraw/zinc/73/25/42/432732542.db2.gz OOTNDTLAEVZVFR-IKGGRYGDSA-N 0 3 304.409 3.014 20 70 DGIDHN CC(C)C(=O)N1CCC(NCc2ccc(Cl)cc2F)CC1 ZINC000160761677 432738225 /nfs/dbraw/zinc/73/82/25/432738225.db2.gz VJCUTERIUXFZFZ-UHFFFAOYSA-N 0 3 312.816 3.216 20 70 DGIDHN COc1c(F)cc(NC(=O)c2ccc(CN(C)C)cc2)cc1F ZINC000160739273 432739209 /nfs/dbraw/zinc/73/92/09/432739209.db2.gz JOBQIEAWYDFFGH-UHFFFAOYSA-N 0 3 320.339 3.287 20 70 DGIDHN CN1CC[C@@H]2[C@@H](CCCN2C(=O)CCCSC(C)(C)C)C1 ZINC000160768765 290171773 /nfs/dbraw/zinc/17/17/73/290171773.db2.gz KKVLVVLIFJCUDU-LSDHHAIUSA-N 0 3 312.523 3.241 20 70 DGIDHN CCCCc1ccc([C@@H](C)NCC(=O)NCC(F)(F)F)cc1 ZINC000160530824 292816274 /nfs/dbraw/zinc/81/62/74/292816274.db2.gz ZHKDICRMWZQCKV-GFCCVEGCSA-N 0 3 316.367 3.358 20 70 DGIDHN O=C(NC1CCN(C2CC2)CC1)[C@@H]1CC[C@@H]2CCCC[C@H]2C1 ZINC000161292862 292832860 /nfs/dbraw/zinc/83/28/60/292832860.db2.gz SCOVOFPIBLQGEZ-HRCADAONSA-N 0 3 304.478 3.336 20 70 DGIDHN CCC(CC)c1cc(C(=O)N[C@@H](C)CN2CCCCC2)on1 ZINC000160361817 521631273 /nfs/dbraw/zinc/63/12/73/521631273.db2.gz NNMAYVVAIQCQGM-ZDUSSCGKSA-N 0 3 307.438 3.182 20 70 DGIDHN CSC[C@H](CCO)N[C@H](C)c1ccc(F)cc1OC(F)F ZINC000160390980 525698346 /nfs/dbraw/zinc/69/83/46/525698346.db2.gz SJQBBAIBVPUOSJ-KOLCDFICSA-N 0 3 323.380 3.192 20 70 DGIDHN CCC(C)(CC)C(=O)NCC1CCN(c2ccncc2)CC1 ZINC000159423828 546053600 /nfs/dbraw/zinc/05/36/00/546053600.db2.gz PBHLUGBAZMJRAU-UHFFFAOYSA-N 0 3 303.450 3.241 20 70 DGIDHN Cc1ccc(NC(=O)N[C@H](CN2CCCC2)c2ccccc2)cn1 ZINC000161509612 546069959 /nfs/dbraw/zinc/06/99/59/546069959.db2.gz HTOHERWAPRRJSC-GOSISDBHSA-N 0 3 324.428 3.349 20 70 DGIDHN